Jump To Section:

Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References enzymes (1) Show 1 protein XML

enzymes (1) Show 1 protein

Record Information

Version

5.0

Status

Detected but not Quantified

Creation Date

2012-09-06 15:16:51 UTC

Update Date

2022-03-07 02:51:49 UTC

HMDB ID

HMDB0015016

Secondary Accession Numbers

HMDB15016

Metabolite Identification

Common Name

Chlorhexidine

Description

Chlorhexidine is only found in individuals that have used or taken this drug. It is a disinfectant and topical anti-infective agent used also as mouthwash to prevent oral plaque. [PubChem]Chlorhexidine's antimicrobial effects are associated with the attractions between chlorhexidine (cation) and negatively charged bacterial cells. After chlorhexidine is absorpted onto the organism's cell wall, it disrupts the integrity of the cell membrane and causes the leakage of intracellular components of the organisms.

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI

[NO NAME]
  Mrv0541 04241205072D          
Created with ChemWriter - http://chemwriter.com
 34 35  0  0  0  0            999 V2000
    3.8861    1.4562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6006    1.8687    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3151    1.4562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3151    0.6312    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0296    1.8687    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7440    1.4562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7440    0.6312    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4585    1.8687    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.1730    1.4562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8752    1.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1969    0.6316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9231    0.2400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6013    1.4978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6253    0.6731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3397    0.2606    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.8861    0.6312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1716    0.2187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1716   -0.6063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8861   -1.0188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8861   -1.8438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6006   -2.2563    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3150   -1.8438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3150   -1.0188    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0295   -2.2563    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7440   -1.8438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7440   -1.0188    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4585   -2.2563    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.1729   -1.8438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8874   -0.6063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1729   -1.0188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8874   -2.2563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6019   -1.8438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6019   -1.0188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3163   -0.6063    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  5  1  0  0  0  0
  3  4  2  0  0  0  0
  5  6  1  0  0  0  0
  6  8  1  0  0  0  0
  6  7  2  0  0  0  0
  8  9  1  0  0  0  0
 10  9  2  0  0  0  0
  9 11  1  0  0  0  0
 10 13  1  0  0  0  0
 11 12  2  0  0  0  0
 12 14  1  0  0  0  0
 14 13  2  0  0  0  0
 14 15  1  0  0  0  0
  1 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 30 28  2  0  0  0  0
 28 31  1  0  0  0  0
 29 30  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
 29 33  2  0  0  0  0
 33 34  1  0  0  0  0
M  END

HMDB0015016
     RDKit          3D
Chlorhexidine
 64 65  0  0  0  0  0  0  0  0999 V2000
   -4.6062    1.0771   -1.6235 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2693   -0.1128   -1.9190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0850   -0.4679   -2.6108 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8994    0.3105   -2.4385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3079    0.1854   -1.0289 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0775    1.0520   -1.0073 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6306    1.0458    0.3079 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1015   -0.3044    0.7367 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0599   -0.9503   -0.2042 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2686   -0.2257   -0.4295 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2479   -0.7447   -1.3022 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0579   -1.8052   -2.0097 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4931   -0.0832   -1.4151 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9195    0.7563   -0.3505 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0588    2.0280   -0.5253 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1816    0.1402    0.8971 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5259    0.1679    1.3842 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5422    0.7645    0.6775 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8379    0.7989    1.1334 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1498    0.2157    2.3479 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7797    0.2482    2.9417 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    9.1265   -0.3825    3.0548 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8231   -0.4245    2.6102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1298   -1.1930   -1.5378 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5345   -1.0101   -1.4630 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0976   -0.2096   -2.2883 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2979   -1.7079   -0.4860 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0187   -1.0005    0.4977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9917    0.3880    0.5272 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7048    1.0870    1.4997 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4478    0.4483    2.4487 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3316    1.3535    3.6558 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -9.4633   -0.9416    2.4039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7666   -1.6520    1.4526 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0727    1.9304   -1.8434 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0411   -1.2903   -3.2535 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1916    1.3911   -2.5794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1117    0.1105   -3.1786 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0823   -0.8811   -0.8777 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0446    0.4942   -0.2663 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5595    0.7990   -1.8576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4376    2.1067   -1.1754 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5221    1.6990    0.2121 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0231    1.4636    1.0858 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6244   -0.1797    1.7161 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2747   -1.0207    0.9261 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6074   -1.2013   -1.1859 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3477   -1.9371    0.2490 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4192    0.6799    0.0510 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1546   -2.3290   -1.9616 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0832   -0.2164   -2.2730 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3719    2.5954    0.2822 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4453   -0.3180    1.4517 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3067    1.2292   -0.2849 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6451    1.2615    0.5930 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3583   -0.8425    4.0074 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0214   -0.8825    3.1442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7179   -2.1390   -1.3086 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5419    0.2954   -2.9968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3419   -2.7555   -0.4751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4083    0.9108   -0.2165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6436    2.1693    1.4697 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0573   -1.4363    3.1631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8004   -2.7499    1.4454 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  3
 11 13  1  0
 13 14  1  0
 14 15  2  3
 14 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 20 22  1  0
 22 23  2  0
  2 24  1  0
 24 25  1  0
 25 26  2  3
 25 27  1  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 30 31  2  0
 31 32  1  0
 31 33  1  0
 33 34  2  0
 23 17  1  0
 34 28  1  0
  1 35  1  0
  3 36  1  0
  4 37  1  0
  4 38  1  0
  5 39  1  0
  5 40  1  0
  6 41  1  0
  6 42  1  0
  7 43  1  0
  7 44  1  0
  8 45  1  0
  8 46  1  0
  9 47  1  0
  9 48  1  0
 10 49  1  0
 12 50  1  0
 13 51  1  0
 15 52  1  0
 16 53  1  0
 18 54  1  0
 19 55  1  0
 22 56  1  0
 23 57  1  0
 24 58  1  0
 26 59  1  0
 27 60  1  0
 29 61  1  0
 30 62  1  0
 33 63  1  0
 34 64  1  0
M  END

[NO NAME]
  Mrv0541 04241205072D          
Created with ChemWriter - http://chemwriter.com
 34 35  0  0  0  0            999 V2000
    3.8861    1.4562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6006    1.8687    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3151    1.4562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3151    0.6312    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0296    1.8687    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7440    1.4562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7440    0.6312    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4585    1.8687    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.1730    1.4562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8752    1.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1969    0.6316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9231    0.2400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6013    1.4978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6253    0.6731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3397    0.2606    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.8861    0.6312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1716    0.2187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1716   -0.6063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8861   -1.0188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8861   -1.8438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6006   -2.2563    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3150   -1.8438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3150   -1.0188    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0295   -2.2563    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7440   -1.8438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7440   -1.0188    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4585   -2.2563    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.1729   -1.8438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8874   -0.6063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1729   -1.0188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8874   -2.2563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6019   -1.8438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6019   -1.0188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3163   -0.6063    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  5  1  0  0  0  0
  3  4  2  0  0  0  0
  5  6  1  0  0  0  0
  6  8  1  0  0  0  0
  6  7  2  0  0  0  0
  8  9  1  0  0  0  0
 10  9  2  0  0  0  0
  9 11  1  0  0  0  0
 10 13  1  0  0  0  0
 11 12  2  0  0  0  0
 12 14  1  0  0  0  0
 14 13  2  0  0  0  0
 14 15  1  0  0  0  0
  1 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 30 28  2  0  0  0  0
 28 31  1  0  0  0  0
 29 30  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
 29 33  2  0  0  0  0
 33 34  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0015016

> <DATABASE_NAME>
hmdb

> <SMILES>
ClC1=CC=C(NC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC2=CC=C(Cl)C=C2)C=C1

> <INCHI_IDENTIFIER>
InChI=1S/C22H30Cl2N10/c23-15-5-9-17(10-6-15)31-21(27)33-19(25)29-13-3-1-2-4-14-30-20(26)34-22(28)32-18-11-7-16(24)8-12-18/h5-12H,1-4,13-14H2,(H5,25,27,29,31,33)(H5,26,28,30,32,34)

> <INCHI_KEY>
GHXZTYHSJHQHIJ-UHFFFAOYSA-N

> <FORMULA>
C22H30Cl2N10

> <MOLECULAR_WEIGHT>
505.447

> <EXACT_MASS>
504.203196424

> <JCHEM_ACCEPTOR_COUNT>
10

> <JCHEM_AVERAGE_POLARIZABILITY>
54.59983398247406

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
10

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
N-(4-chlorophenyl)-1-3-(6-{N-[3-(4-chlorophenyl)carbamimidamidomethanimidoyl]amino}hexyl)carbamimidamidomethanimidamide

> <ALOGPS_LOGP>
2.71

> <JCHEM_LOGP>
4.510369177333333

> <ALOGPS_LOGS>
-4.29

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
2

> <JCHEM_PHYSIOLOGICAL_CHARGE>
4

> <JCHEM_PKA_STRONGEST_BASIC>
10.516535500120664

> <JCHEM_POLAR_SURFACE_AREA>
167.58

> <JCHEM_REFRACTIVITY>
181.71459999999993

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
2.61e-02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
chlorhexidine

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0015016
     RDKit          3D
Chlorhexidine
 64 65  0  0  0  0  0  0  0  0999 V2000
   -4.6062    1.0771   -1.6235 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2693   -0.1128   -1.9190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0850   -0.4679   -2.6108 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8994    0.3105   -2.4385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3079    0.1854   -1.0289 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0775    1.0520   -1.0073 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6306    1.0458    0.3079 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1015   -0.3044    0.7367 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0599   -0.9503   -0.2042 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2686   -0.2257   -0.4295 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2479   -0.7447   -1.3022 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0579   -1.8052   -2.0097 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4931   -0.0832   -1.4151 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9195    0.7563   -0.3505 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0588    2.0280   -0.5253 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1816    0.1402    0.8971 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5259    0.1679    1.3842 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5422    0.7645    0.6775 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8379    0.7989    1.1334 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1498    0.2157    2.3479 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7797    0.2482    2.9417 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    9.1265   -0.3825    3.0548 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8231   -0.4245    2.6102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1298   -1.1930   -1.5378 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5345   -1.0101   -1.4630 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0976   -0.2096   -2.2883 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2979   -1.7079   -0.4860 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0187   -1.0005    0.4977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9917    0.3880    0.5272 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7048    1.0870    1.4997 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4478    0.4483    2.4487 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3316    1.3535    3.6558 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -9.4633   -0.9416    2.4039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7666   -1.6520    1.4526 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0727    1.9304   -1.8434 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0411   -1.2903   -3.2535 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1916    1.3911   -2.5794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1117    0.1105   -3.1786 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0823   -0.8811   -0.8777 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0446    0.4942   -0.2663 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5595    0.7990   -1.8576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4376    2.1067   -1.1754 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5221    1.6990    0.2121 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0231    1.4636    1.0858 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6244   -0.1797    1.7161 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2747   -1.0207    0.9261 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6074   -1.2013   -1.1859 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3477   -1.9371    0.2490 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4192    0.6799    0.0510 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1546   -2.3290   -1.9616 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0832   -0.2164   -2.2730 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3719    2.5954    0.2822 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4453   -0.3180    1.4517 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3067    1.2292   -0.2849 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6451    1.2615    0.5930 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3583   -0.8425    4.0074 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0214   -0.8825    3.1442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7179   -2.1390   -1.3086 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5419    0.2954   -2.9968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3419   -2.7555   -0.4751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4083    0.9108   -0.2165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6436    2.1693    1.4697 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0573   -1.4363    3.1631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8004   -2.7499    1.4454 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  3
 11 13  1  0
 13 14  1  0
 14 15  2  3
 14 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 20 22  1  0
 22 23  2  0
  2 24  1  0
 24 25  1  0
 25 26  2  3
 25 27  1  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 30 31  2  0
 31 32  1  0
 31 33  1  0
 33 34  2  0
 23 17  1  0
 34 28  1  0
  1 35  1  0
  3 36  1  0
  4 37  1  0
  4 38  1  0
  5 39  1  0
  5 40  1  0
  6 41  1  0
  6 42  1  0
  7 43  1  0
  7 44  1  0
  8 45  1  0
  8 46  1  0
  9 47  1  0
  9 48  1  0
 10 49  1  0
 12 50  1  0
 13 51  1  0
 15 52  1  0
 16 53  1  0
 18 54  1  0
 19 55  1  0
 22 56  1  0
 23 57  1  0
 24 58  1  0
 26 59  1  0
 27 60  1  0
 29 61  1  0
 30 62  1  0
 33 63  1  0
 34 64  1  0
M  END

HEADER    PROTEIN                                 24-APR-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: [NO NAME]                                         
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-APR-12         0                                  
HETATM    1  C   UNK     0       7.254   2.718   0.000  0.00  0.00           C+0
HETATM    2  N   UNK     0       8.588   3.488   0.000  0.00  0.00           N+0
HETATM    3  C   UNK     0       9.922   2.718   0.000  0.00  0.00           C+0
HETATM    4  N   UNK     0       9.922   1.178   0.000  0.00  0.00           N+0
HETATM    5  N   UNK     0      11.255   3.488   0.000  0.00  0.00           N+0
HETATM    6  C   UNK     0      12.589   2.718   0.000  0.00  0.00           C+0
HETATM    7  N   UNK     0      12.589   1.178   0.000  0.00  0.00           N+0
HETATM    8  N   UNK     0      13.923   3.488   0.000  0.00  0.00           N+0
HETATM    9  C   UNK     0      15.256   2.718   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      16.567   3.527   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      15.301   1.179   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      16.656   0.448   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      17.922   2.796   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      17.967   1.256   0.000  0.00  0.00           C+0
HETATM   15 Cl   UNK     0      19.301   0.486   0.000  0.00  0.00          Cl+0
HETATM   16  C   UNK     0       7.254   1.178   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       5.920   0.408   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       5.920  -1.132   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       7.254  -1.902   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       7.254  -3.442   0.000  0.00  0.00           C+0
HETATM   21  N   UNK     0       8.588  -4.212   0.000  0.00  0.00           N+0
HETATM   22  C   UNK     0       9.921  -3.442   0.000  0.00  0.00           C+0
HETATM   23  N   UNK     0       9.921  -1.902   0.000  0.00  0.00           N+0
HETATM   24  N   UNK     0      11.255  -4.212   0.000  0.00  0.00           N+0
HETATM   25  C   UNK     0      12.589  -3.442   0.000  0.00  0.00           C+0
HETATM   26  N   UNK     0      12.589  -1.902   0.000  0.00  0.00           N+0
HETATM   27  N   UNK     0      13.923  -4.212   0.000  0.00  0.00           N+0
HETATM   28  C   UNK     0      15.256  -3.442   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      16.590  -1.132   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      15.256  -1.902   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      16.590  -4.212   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      17.924  -3.442   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      17.924  -1.902   0.000  0.00  0.00           C+0
HETATM   34 Cl   UNK     0      19.257  -1.132   0.000  0.00  0.00          Cl+0
CONECT    1    2   16                                                       
CONECT    2    1    3                                                       
CONECT    3    2    5    4                                                  
CONECT    4    3                                                            
CONECT    5    3    6                                                       
CONECT    6    5    8    7                                                  
CONECT    7    6                                                            
CONECT    8    6    9                                                       
CONECT    9    8   10   11                                                  
CONECT   10    9   13                                                       
CONECT   11    9   12                                                       
CONECT   12   11   14                                                       
CONECT   13   10   14                                                       
CONECT   14   12   13   15                                                  
CONECT   15   14                                                            
CONECT   16    1   17                                                       
CONECT   17   16   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20                                                       
CONECT   20   19   21                                                       
CONECT   21   20   22                                                       
CONECT   22   21   23   24                                                  
CONECT   23   22                                                            
CONECT   24   22   25                                                       
CONECT   25   24   26   27                                                  
CONECT   26   25                                                            
CONECT   27   25   28                                                       
CONECT   28   27   30   31                                                  
CONECT   29   30   33                                                       
CONECT   30   28   29                                                       
CONECT   31   28   32                                                       
CONECT   32   31   33                                                       
CONECT   33   32   29   34                                                  
CONECT   34   33                                                            
MASTER        0    0    0    0    0    0    0    0   34    0   70    0
END

COMPND    HMDB0015016
HETATM    1  N1  UNL     1      -4.606   1.077  -1.624  1.00  0.00           N  
HETATM    2  C1  UNL     1      -4.269  -0.113  -1.919  1.00  0.00           C  
HETATM    3  N2  UNL     1      -3.085  -0.468  -2.611  1.00  0.00           N  
HETATM    4  C2  UNL     1      -1.899   0.310  -2.438  1.00  0.00           C  
HETATM    5  C3  UNL     1      -1.308   0.185  -1.029  1.00  0.00           C  
HETATM    6  C4  UNL     1      -0.078   1.052  -1.007  1.00  0.00           C  
HETATM    7  C5  UNL     1       0.631   1.046   0.308  1.00  0.00           C  
HETATM    8  C6  UNL     1       1.101  -0.304   0.737  1.00  0.00           C  
HETATM    9  C7  UNL     1       2.060  -0.950  -0.204  1.00  0.00           C  
HETATM   10  N3  UNL     1       3.269  -0.226  -0.429  1.00  0.00           N  
HETATM   11  C8  UNL     1       4.248  -0.745  -1.302  1.00  0.00           C  
HETATM   12  N4  UNL     1       4.058  -1.805  -2.010  1.00  0.00           N  
HETATM   13  N5  UNL     1       5.493  -0.083  -1.415  1.00  0.00           N  
HETATM   14  C9  UNL     1       5.919   0.756  -0.350  1.00  0.00           C  
HETATM   15  N6  UNL     1       6.059   2.028  -0.525  1.00  0.00           N  
HETATM   16  N7  UNL     1       6.182   0.140   0.897  1.00  0.00           N  
HETATM   17  C10 UNL     1       7.526   0.168   1.384  1.00  0.00           C  
HETATM   18  C11 UNL     1       8.542   0.765   0.678  1.00  0.00           C  
HETATM   19  C12 UNL     1       9.838   0.799   1.133  1.00  0.00           C  
HETATM   20  C13 UNL     1      10.150   0.216   2.348  1.00  0.00           C  
HETATM   21 CL1  UNL     1      11.780   0.248   2.942  1.00  0.00          CL  
HETATM   22  C14 UNL     1       9.127  -0.383   3.055  1.00  0.00           C  
HETATM   23  C15 UNL     1       7.823  -0.425   2.610  1.00  0.00           C  
HETATM   24  N8  UNL     1      -5.130  -1.193  -1.538  1.00  0.00           N  
HETATM   25  C16 UNL     1      -6.535  -1.010  -1.463  1.00  0.00           C  
HETATM   26  N9  UNL     1      -7.098  -0.210  -2.288  1.00  0.00           N  
HETATM   27  N10 UNL     1      -7.298  -1.708  -0.486  1.00  0.00           N  
HETATM   28  C17 UNL     1      -8.019  -1.001   0.498  1.00  0.00           C  
HETATM   29  C18 UNL     1      -7.992   0.388   0.527  1.00  0.00           C  
HETATM   30  C19 UNL     1      -8.705   1.087   1.500  1.00  0.00           C  
HETATM   31  C20 UNL     1      -9.448   0.448   2.449  1.00  0.00           C  
HETATM   32 CL2  UNL     1     -10.332   1.353   3.656  1.00  0.00          CL  
HETATM   33  C21 UNL     1      -9.463  -0.942   2.404  1.00  0.00           C  
HETATM   34  C22 UNL     1      -8.767  -1.652   1.453  1.00  0.00           C  
HETATM   35  H1  UNL     1      -4.073   1.930  -1.843  1.00  0.00           H  
HETATM   36  H2  UNL     1      -3.041  -1.290  -3.254  1.00  0.00           H  
HETATM   37  H3  UNL     1      -2.192   1.391  -2.579  1.00  0.00           H  
HETATM   38  H4  UNL     1      -1.112   0.110  -3.179  1.00  0.00           H  
HETATM   39  H5  UNL     1      -1.082  -0.881  -0.878  1.00  0.00           H  
HETATM   40  H6  UNL     1      -2.045   0.494  -0.266  1.00  0.00           H  
HETATM   41  H7  UNL     1       0.560   0.799  -1.858  1.00  0.00           H  
HETATM   42  H8  UNL     1      -0.438   2.107  -1.175  1.00  0.00           H  
HETATM   43  H9  UNL     1       1.522   1.699   0.212  1.00  0.00           H  
HETATM   44  H10 UNL     1      -0.023   1.464   1.086  1.00  0.00           H  
HETATM   45  H11 UNL     1       1.624  -0.180   1.716  1.00  0.00           H  
HETATM   46  H12 UNL     1       0.275  -1.021   0.926  1.00  0.00           H  
HETATM   47  H13 UNL     1       1.607  -1.201  -1.186  1.00  0.00           H  
HETATM   48  H14 UNL     1       2.348  -1.937   0.249  1.00  0.00           H  
HETATM   49  H15 UNL     1       3.419   0.680   0.051  1.00  0.00           H  
HETATM   50  H16 UNL     1       3.155  -2.329  -1.962  1.00  0.00           H  
HETATM   51  H17 UNL     1       6.083  -0.216  -2.273  1.00  0.00           H  
HETATM   52  H18 UNL     1       6.372   2.595   0.282  1.00  0.00           H  
HETATM   53  H19 UNL     1       5.445  -0.318   1.452  1.00  0.00           H  
HETATM   54  H20 UNL     1       8.307   1.229  -0.285  1.00  0.00           H  
HETATM   55  H21 UNL     1      10.645   1.262   0.593  1.00  0.00           H  
HETATM   56  H22 UNL     1       9.358  -0.843   4.007  1.00  0.00           H  
HETATM   57  H23 UNL     1       7.021  -0.883   3.144  1.00  0.00           H  
HETATM   58  H24 UNL     1      -4.718  -2.139  -1.309  1.00  0.00           H  
HETATM   59  H25 UNL     1      -6.542   0.295  -2.997  1.00  0.00           H  
HETATM   60  H26 UNL     1      -7.342  -2.755  -0.475  1.00  0.00           H  
HETATM   61  H27 UNL     1      -7.408   0.911  -0.216  1.00  0.00           H  
HETATM   62  H28 UNL     1      -8.644   2.169   1.470  1.00  0.00           H  
HETATM   63  H29 UNL     1     -10.057  -1.436   3.163  1.00  0.00           H  
HETATM   64  H30 UNL     1      -8.800  -2.750   1.445  1.00  0.00           H  
CONECT    1    2    2   35
CONECT    2    3   24
CONECT    3    4   36
CONECT    4    5   37   38
CONECT    5    6   39   40
CONECT    6    7   41   42
CONECT    7    8   43   44
CONECT    8    9   45   46
CONECT    9   10   47   48
CONECT   10   11   49
CONECT   11   12   12   13
CONECT   12   50
CONECT   13   14   51
CONECT   14   15   15   16
CONECT   15   52
CONECT   16   17   53
CONECT   17   18   18   23
CONECT   18   19   54
CONECT   19   20   20   55
CONECT   20   21   22
CONECT   22   23   23   56
CONECT   23   57
CONECT   24   25   58
CONECT   25   26   26   27
CONECT   26   59
CONECT   27   28   60
CONECT   28   29   29   34
CONECT   29   30   61
CONECT   30   31   31   62
CONECT   31   32   33
CONECT   33   34   34   63
CONECT   34   64
END

HMDB0015016
     RDKit          3D
Chlorhexidine
 64 65  0  0  0  0  0  0  0  0999 V2000
   -4.6062    1.0771   -1.6235 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2693   -0.1128   -1.9190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0850   -0.4679   -2.6108 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8994    0.3105   -2.4385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3079    0.1854   -1.0289 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0775    1.0520   -1.0073 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6306    1.0458    0.3079 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1015   -0.3044    0.7367 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0599   -0.9503   -0.2042 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2686   -0.2257   -0.4295 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2479   -0.7447   -1.3022 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0579   -1.8052   -2.0097 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4931   -0.0832   -1.4151 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9195    0.7563   -0.3505 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0588    2.0280   -0.5253 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1816    0.1402    0.8971 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5259    0.1679    1.3842 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5422    0.7645    0.6775 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8379    0.7989    1.1334 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1498    0.2157    2.3479 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7797    0.2482    2.9417 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    9.1265   -0.3825    3.0548 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8231   -0.4245    2.6102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1298   -1.1930   -1.5378 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5345   -1.0101   -1.4630 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0976   -0.2096   -2.2883 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2979   -1.7079   -0.4860 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0187   -1.0005    0.4977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9917    0.3880    0.5272 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7048    1.0870    1.4997 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4478    0.4483    2.4487 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3316    1.3535    3.6558 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -9.4633   -0.9416    2.4039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7666   -1.6520    1.4526 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0727    1.9304   -1.8434 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0411   -1.2903   -3.2535 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1916    1.3911   -2.5794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1117    0.1105   -3.1786 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0823   -0.8811   -0.8777 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0446    0.4942   -0.2663 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5595    0.7990   -1.8576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4376    2.1067   -1.1754 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5221    1.6990    0.2121 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0231    1.4636    1.0858 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6244   -0.1797    1.7161 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2747   -1.0207    0.9261 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6074   -1.2013   -1.1859 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3477   -1.9371    0.2490 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4192    0.6799    0.0510 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1546   -2.3290   -1.9616 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0832   -0.2164   -2.2730 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3719    2.5954    0.2822 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4453   -0.3180    1.4517 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3067    1.2292   -0.2849 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6451    1.2615    0.5930 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3583   -0.8425    4.0074 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0214   -0.8825    3.1442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7179   -2.1390   -1.3086 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5419    0.2954   -2.9968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3419   -2.7555   -0.4751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4083    0.9108   -0.2165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6436    2.1693    1.4697 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0573   -1.4363    3.1631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8004   -2.7499    1.4454 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  3
 11 13  1  0
 13 14  1  0
 14 15  2  3
 14 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 20 22  1  0
 22 23  2  0
  2 24  1  0
 24 25  1  0
 25 26  2  3
 25 27  1  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 30 31  2  0
 31 32  1  0
 31 33  1  0
 33 34  2  0
 23 17  1  0
 34 28  1  0
  1 35  1  0
  3 36  1  0
  4 37  1  0
  4 38  1  0
  5 39  1  0
  5 40  1  0
  6 41  1  0
  6 42  1  0
  7 43  1  0
  7 44  1  0
  8 45  1  0
  8 46  1  0
  9 47  1  0
  9 48  1  0
 10 49  1  0
 12 50  1  0
 13 51  1  0
 15 52  1  0
 16 53  1  0
 18 54  1  0
 19 55  1  0
 22 56  1  0
 23 57  1  0
 24 58  1  0
 26 59  1  0
 27 60  1  0
 29 61  1  0
 30 62  1  0
 33 63  1  0
 34 64  1  0
M  END

View in JSmol View Stereo Labels

Synonyms

Value	Source
1,1'-Hexamethylene bis(5-(p-chlorophenyl)biguanide)	ChEBI
N,N'-bis(4-chlorophenyl)-3,12-diimino-2,4,11,13-tetraazatetradecanediimidamide	ChEBI
Dentisept	Kegg
Merfen-incolore	Kegg
Cloresidina	HMDB

Chemical Formula

C₂₂H₃₀Cl₂N₁₀

Average Molecular Weight

505.447

Monoisotopic Molecular Weight

504.203196424

IUPAC Name

N-(4-chlorophenyl)-1-3-(6-{N-[3-(4-chlorophenyl)carbamimidamidomethanimidoyl]amino}hexyl)carbamimidamidomethanimidamide

Traditional Name

chlorhexidine

CAS Registry Number

55-56-1

SMILES

ClC1=CC=C(NC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC2=CC=C(Cl)C=C2)C=C1

InChI Identifier

InChI=1S/C22H30Cl2N10/c23-15-5-9-17(10-6-15)31-21(27)33-19(25)29-13-3-1-2-4-14-30-20(26)34-22(28)32-18-11-7-16(24)8-12-18/h5-12H,1-4,13-14H2,(H5,25,27,29,31,33)(H5,26,28,30,32,34)

InChI Key

GHXZTYHSJHQHIJ-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as chlorobenzenes. Chlorobenzenes are compounds containing one or more chlorine atoms attached to a benzene moiety.

Kingdom

Organic compounds

Super Class

Benzenoids

Class

Benzene and substituted derivatives

Sub Class

Halobenzenes

Direct Parent

Chlorobenzenes

Alternative Parents

Substituents

Chlorobenzene
Biguanide
Aryl halide
Aryl chloride
Guanidine
Organic 1,3-dipolar compound
Propargyl-type 1,3-dipolar organic compound
Carboximidamide
Organic nitrogen compound
Organopnictogen compound
Hydrocarbon derivative
Organonitrogen compound
Organochloride
Organohalogen compound
Imine
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic compounds

External Descriptors

monochlorobenzenes (CHEBI:3614 )
biguanides (CHEBI:3614 )

Ontology

Not Available

Urine (PMID: 21059682)

Non-excretory biofluid

Blood (PMID: 21059682)
Saliva (PMID: 12097436)

Cellular substructure

Cytoplasm (HMDB: HMDB0015016)

Process

Not Available

Role

Not Available

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	134 °C	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	0.026 g/L	Not Available
LogP	3	Not Available

Experimental Chromatographic Properties

Experimental Collision Cross Sections

Adduct Type	Data Source	CCS Value (Å²)	Reference
[M+H]+	CBM	222.3	30932474

Predicted Molecular Properties

Property	Value	Source
Water Solubility	0.026 g/L	ALOGPS
logP	2.71	ALOGPS
logP	4.51	ChemAxon
logS	-4.3	ALOGPS
pKa (Strongest Basic)	10.52	ChemAxon
Physiological Charge	4	ChemAxon
Hydrogen Acceptor Count	10	ChemAxon
Hydrogen Donor Count	10	ChemAxon
Polar Surface Area	167.58 Å²	ChemAxon
Rotatable Bond Count	9	ChemAxon
Refractivity	181.71 m³·mol⁻¹	ChemAxon
Polarizability	54.6 Å³	ChemAxon
Number of Rings	2	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DeepCCS	[M+H]+	221.378	30932474
DeepCCS	[M-H]-	219.02	30932474
DeepCCS	[M-2H]-	252.57	30932474
DeepCCS	[M+Na]+	227.935	30932474
AllCCS	[M+H]+	211.1	32859911
AllCCS	[M+H-H2O]+	209.4	32859911
AllCCS	[M+NH4]+	212.6	32859911
AllCCS	[M+Na]+	213.0	32859911
AllCCS	[M-H]-	207.8	32859911
AllCCS	[M+Na-2H]-	209.7	32859911
AllCCS	[M+HCOO]-	212.0	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Chlorhexidine	ClC1=CC=C(NC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC2=CC=C(Cl)C=C2)C=C1	6740.7	Standard polar	33892256
Chlorhexidine	ClC1=CC=C(NC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC2=CC=C(Cl)C=C2)C=C1	3949.7	Standard non polar	33892256
Chlorhexidine	ClC1=CC=C(NC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC2=CC=C(Cl)C=C2)C=C1	5218.3	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Chlorhexidine,1TMS,isomer #1	C[Si](C)(C)N(C(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1	5337.8	Semi standard non polar	33892256
Chlorhexidine,1TMS,isomer #1	C[Si](C)(C)N(C(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1	4002.6	Standard non polar	33892256
Chlorhexidine,1TMS,isomer #1	C[Si](C)(C)N(C(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1	9096.9	Standard polar	33892256
Chlorhexidine,1TMS,isomer #2	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC1=CC=C(Cl)C=C1	5461.1	Semi standard non polar	33892256
Chlorhexidine,1TMS,isomer #2	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC1=CC=C(Cl)C=C1	3981.8	Standard non polar	33892256
Chlorhexidine,1TMS,isomer #2	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC1=CC=C(Cl)C=C1	9073.5	Standard polar	33892256
Chlorhexidine,1TMS,isomer #3	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC1=CC=C(Cl)C=C1	5419.9	Semi standard non polar	33892256
Chlorhexidine,1TMS,isomer #3	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC1=CC=C(Cl)C=C1	4364.3	Standard non polar	33892256
Chlorhexidine,1TMS,isomer #3	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC1=CC=C(Cl)C=C1	9044.0	Standard polar	33892256
Chlorhexidine,1TMS,isomer #4	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	5456.5	Semi standard non polar	33892256
Chlorhexidine,1TMS,isomer #4	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	4031.1	Standard non polar	33892256
Chlorhexidine,1TMS,isomer #4	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	8969.9	Standard polar	33892256
Chlorhexidine,1TMS,isomer #5	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	5392.6	Semi standard non polar	33892256
Chlorhexidine,1TMS,isomer #5	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4352.7	Standard non polar	33892256
Chlorhexidine,1TMS,isomer #5	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	9140.7	Standard polar	33892256
Chlorhexidine,2TMS,isomer #1	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	5218.1	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #1	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3404.5	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #1	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	8341.1	Standard polar	33892256
Chlorhexidine,2TMS,isomer #10	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	5241.5	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #10	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3635.8	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #10	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	8387.3	Standard polar	33892256
Chlorhexidine,2TMS,isomer #11	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5272.1	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #11	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3551.6	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #11	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	8446.7	Standard polar	33892256
Chlorhexidine,2TMS,isomer #12	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5237.9	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #12	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3888.0	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #12	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	8514.3	Standard polar	33892256
Chlorhexidine,2TMS,isomer #13	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5251.2	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #13	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3902.6	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #13	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	8504.0	Standard polar	33892256
Chlorhexidine,2TMS,isomer #14	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	5305.2	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #14	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	3598.9	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #14	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	8444.8	Standard polar	33892256
Chlorhexidine,2TMS,isomer #15	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5230.9	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #15	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3930.3	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #15	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	8399.4	Standard polar	33892256
Chlorhexidine,2TMS,isomer #16	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC1=CC=C(Cl)C=C1	5294.9	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #16	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC1=CC=C(Cl)C=C1	3526.6	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #16	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC1=CC=C(Cl)C=C1	8542.7	Standard polar	33892256
Chlorhexidine,2TMS,isomer #17	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	5250.3	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #17	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3689.9	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #17	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	8306.3	Standard polar	33892256
Chlorhexidine,2TMS,isomer #18	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	5237.4	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #18	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4256.2	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #18	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	8422.1	Standard polar	33892256
Chlorhexidine,2TMS,isomer #19	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	5208.8	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #19	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4266.2	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #19	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	8349.6	Standard polar	33892256
Chlorhexidine,2TMS,isomer #2	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	5162.1	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #2	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3932.3	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #2	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	8370.1	Standard polar	33892256
Chlorhexidine,2TMS,isomer #20	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5243.7	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #20	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3989.7	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #20	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	8289.3	Standard polar	33892256
Chlorhexidine,2TMS,isomer #21	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	5183.2	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #21	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	4282.5	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #21	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	8226.3	Standard polar	33892256
Chlorhexidine,2TMS,isomer #22	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	5281.1	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #22	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3534.3	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #22	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	8367.3	Standard polar	33892256
Chlorhexidine,2TMS,isomer #23	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5258.6	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #23	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3961.0	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #23	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	8398.0	Standard polar	33892256
Chlorhexidine,2TMS,isomer #24	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	5324.7	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #24	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	3672.4	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #24	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	8346.3	Standard polar	33892256
Chlorhexidine,2TMS,isomer #25	C[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	5228.0	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #25	C[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4260.8	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #25	C[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	8465.0	Standard polar	33892256
Chlorhexidine,2TMS,isomer #3	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	5203.8	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #3	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3615.7	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #3	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	8377.9	Standard polar	33892256
Chlorhexidine,2TMS,isomer #4	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	5171.1	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #4	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3903.4	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #4	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	8450.3	Standard polar	33892256
Chlorhexidine,2TMS,isomer #5	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	5156.8	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #5	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	3901.9	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #5	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	8432.4	Standard polar	33892256
Chlorhexidine,2TMS,isomer #6	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5209.6	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #6	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3628.4	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #6	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	8368.0	Standard polar	33892256
Chlorhexidine,2TMS,isomer #7	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	5136.1	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #7	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	3917.0	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #7	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	8321.3	Standard polar	33892256
Chlorhexidine,2TMS,isomer #8	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5198.5	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #8	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3592.8	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #8	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	8473.0	Standard polar	33892256
Chlorhexidine,2TMS,isomer #9	C[Si](C)(C)N(C(=N)NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C1=CC=C(Cl)C=C1	5078.7	Semi standard non polar	33892256
Chlorhexidine,2TMS,isomer #9	C[Si](C)(C)N(C(=N)NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C1=CC=C(Cl)C=C1	3574.4	Standard non polar	33892256
Chlorhexidine,2TMS,isomer #9	C[Si](C)(C)N(C(=N)NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C1=CC=C(Cl)C=C1	8397.3	Standard polar	33892256
Chlorhexidine,3TMS,isomer #1	C[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	5016.6	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #1	C[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3533.9	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #1	C[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7660.2	Standard polar	33892256
Chlorhexidine,3TMS,isomer #10	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	5013.0	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #10	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3900.7	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #10	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7813.3	Standard polar	33892256
Chlorhexidine,3TMS,isomer #11	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4979.4	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #11	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	3915.5	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #11	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	7748.6	Standard polar	33892256
Chlorhexidine,3TMS,isomer #12	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4984.8	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #12	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3679.0	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #12	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7740.0	Standard polar	33892256
Chlorhexidine,3TMS,isomer #13	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	4952.4	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #13	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	3940.0	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #13	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	7631.2	Standard polar	33892256
Chlorhexidine,3TMS,isomer #14	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4989.3	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #14	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3640.6	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #14	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7845.3	Standard polar	33892256
Chlorhexidine,3TMS,isomer #15	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4886.5	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #15	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3635.8	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #15	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7717.6	Standard polar	33892256
Chlorhexidine,3TMS,isomer #16	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4995.4	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #16	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3367.3	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #16	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7768.6	Standard polar	33892256
Chlorhexidine,3TMS,isomer #17	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4965.5	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #17	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3607.4	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #17	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7830.2	Standard polar	33892256
Chlorhexidine,3TMS,isomer #18	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4962.0	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #18	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3395.6	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #18	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7824.7	Standard polar	33892256
Chlorhexidine,3TMS,isomer #19	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4945.4	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #19	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3655.8	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #19	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7731.2	Standard polar	33892256
Chlorhexidine,3TMS,isomer #2	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4987.3	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #2	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3172.7	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #2	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7763.5	Standard polar	33892256
Chlorhexidine,3TMS,isomer #20	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4965.0	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #20	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3359.1	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #20	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7921.3	Standard polar	33892256
Chlorhexidine,3TMS,isomer #21	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4891.6	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #21	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3354.5	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #21	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7797.5	Standard polar	33892256
Chlorhexidine,3TMS,isomer #22	C[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4983.6	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #22	C[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	3874.6	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #22	C[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	7848.5	Standard polar	33892256
Chlorhexidine,3TMS,isomer #23	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4984.9	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #23	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3614.4	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #23	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7838.3	Standard polar	33892256
Chlorhexidine,3TMS,isomer #24	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4946.0	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #24	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3899.4	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #24	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7739.9	Standard polar	33892256
Chlorhexidine,3TMS,isomer #25	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4987.4	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #25	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3581.4	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #25	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7941.3	Standard polar	33892256
Chlorhexidine,3TMS,isomer #26	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4888.4	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #26	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3599.2	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #26	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7815.4	Standard polar	33892256
Chlorhexidine,3TMS,isomer #27	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4999.3	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #27	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3375.3	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #27	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7745.4	Standard polar	33892256
Chlorhexidine,3TMS,isomer #28	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4975.5	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #28	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3892.1	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #28	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7775.6	Standard polar	33892256
Chlorhexidine,3TMS,isomer #29	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4954.8	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #29	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3575.8	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #29	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7933.7	Standard polar	33892256
Chlorhexidine,3TMS,isomer #3	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	5007.5	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #3	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3416.5	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #3	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7782.2	Standard polar	33892256
Chlorhexidine,3TMS,isomer #30	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4966.7	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #30	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3499.6	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #30	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7694.7	Standard polar	33892256
Chlorhexidine,3TMS,isomer #31	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4944.3	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #31	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3336.8	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #31	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7912.5	Standard polar	33892256
Chlorhexidine,3TMS,isomer #32	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4972.1	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #32	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3458.1	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #32	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7779.6	Standard polar	33892256
Chlorhexidine,3TMS,isomer #33	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	5050.6	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #33	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3138.8	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #33	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7764.6	Standard polar	33892256
Chlorhexidine,3TMS,isomer #34	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	5078.2	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #34	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3552.5	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #34	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7847.1	Standard polar	33892256
Chlorhexidine,3TMS,isomer #35	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	5018.1	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #35	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3589.2	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #35	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7810.8	Standard polar	33892256
Chlorhexidine,3TMS,isomer #36	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5017.1	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #36	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3378.9	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #36	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7805.1	Standard polar	33892256
Chlorhexidine,3TMS,isomer #37	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	5000.4	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #37	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3653.3	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #37	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7702.9	Standard polar	33892256
Chlorhexidine,3TMS,isomer #38	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5028.6	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #38	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3332.4	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #38	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7906.5	Standard polar	33892256
Chlorhexidine,3TMS,isomer #39	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5034.1	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #39	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3176.0	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #39	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7884.2	Standard polar	33892256
Chlorhexidine,3TMS,isomer #4	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	5011.8	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #4	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3417.7	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #4	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7761.6	Standard polar	33892256
Chlorhexidine,3TMS,isomer #40	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4999.2	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #40	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3495.7	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #40	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7944.2	Standard polar	33892256
Chlorhexidine,3TMS,isomer #41	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	5040.9	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #41	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	3269.5	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #41	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	7937.4	Standard polar	33892256
Chlorhexidine,3TMS,isomer #42	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4983.7	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #42	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3557.8	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #42	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7851.9	Standard polar	33892256
Chlorhexidine,3TMS,isomer #43	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5045.6	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #43	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3216.0	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #43	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	8031.6	Standard polar	33892256
Chlorhexidine,3TMS,isomer #44	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5027.1	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #44	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3778.2	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #44	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7965.8	Standard polar	33892256
Chlorhexidine,3TMS,isomer #45	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5009.8	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #45	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3518.7	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #45	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7953.8	Standard polar	33892256
Chlorhexidine,3TMS,isomer #46	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4997.7	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #46	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3824.3	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #46	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7866.7	Standard polar	33892256
Chlorhexidine,3TMS,isomer #47	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5019.1	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #47	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3450.0	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #47	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	8052.6	Standard polar	33892256
Chlorhexidine,3TMS,isomer #48	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5078.9	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #48	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3197.0	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #48	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7873.6	Standard polar	33892256
Chlorhexidine,3TMS,isomer #49	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5074.5	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #49	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3759.8	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #49	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7902.3	Standard polar	33892256
Chlorhexidine,3TMS,isomer #5	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5008.2	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #5	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3189.5	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #5	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7755.6	Standard polar	33892256
Chlorhexidine,3TMS,isomer #50	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5036.9	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #50	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3358.8	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #50	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7826.0	Standard polar	33892256
Chlorhexidine,3TMS,isomer #51	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	5073.5	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #51	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3480.4	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #51	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7679.3	Standard polar	33892256
Chlorhexidine,3TMS,isomer #52	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	5031.1	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #52	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3638.0	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #52	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7723.7	Standard polar	33892256
Chlorhexidine,3TMS,isomer #53	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5030.8	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #53	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3411.4	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #53	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7724.0	Standard polar	33892256
Chlorhexidine,3TMS,isomer #54	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	5008.5	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #54	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3701.6	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #54	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7613.8	Standard polar	33892256
Chlorhexidine,3TMS,isomer #55	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	5074.2	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #55	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4150.2	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #55	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	7805.5	Standard polar	33892256
Chlorhexidine,3TMS,isomer #56	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5070.0	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #56	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3839.2	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #56	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7795.3	Standard polar	33892256
Chlorhexidine,3TMS,isomer #57	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	5042.6	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #57	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4169.1	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #57	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7687.0	Standard polar	33892256
Chlorhexidine,3TMS,isomer #58	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	5039.7	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #58	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3536.6	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #58	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7674.8	Standard polar	33892256
Chlorhexidine,3TMS,isomer #59	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	5070.5	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #59	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3482.0	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #59	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7776.8	Standard polar	33892256
Chlorhexidine,3TMS,isomer #6	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4983.3	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #6	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3459.7	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #6	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7659.9	Standard polar	33892256
Chlorhexidine,3TMS,isomer #60	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5069.9	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #60	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3238.2	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #60	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7773.7	Standard polar	33892256
Chlorhexidine,3TMS,isomer #7	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	5012.2	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #7	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3162.5	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #7	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7854.3	Standard polar	33892256
Chlorhexidine,3TMS,isomer #8	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4936.2	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #8	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3190.1	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #8	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7727.5	Standard polar	33892256
Chlorhexidine,3TMS,isomer #9	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4982.9	Semi standard non polar	33892256
Chlorhexidine,3TMS,isomer #9	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3515.3	Standard non polar	33892256
Chlorhexidine,3TMS,isomer #9	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7705.4	Standard polar	33892256
Chlorhexidine,4TMS,isomer #1	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4847.0	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #1	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3128.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #1	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7112.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #10	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4803.5	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #10	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3020.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #10	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7358.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #100	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4860.8	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #100	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3355.8	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #100	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7388.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #101	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4921.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #101	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3235.3	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #101	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7286.8	Standard polar	33892256
Chlorhexidine,4TMS,isomer #102	C[Si](C)(C)N=C(N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4917.3	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #102	C[Si](C)(C)N=C(N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3497.3	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #102	C[Si](C)(C)N=C(N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7153.5	Standard polar	33892256
Chlorhexidine,4TMS,isomer #103	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4912.3	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #103	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3280.3	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #103	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7191.4	Standard polar	33892256
Chlorhexidine,4TMS,isomer #104	C[Si](C)(C)N=C(N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4905.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #104	C[Si](C)(C)N=C(N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3550.7	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #104	C[Si](C)(C)N=C(N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7048.5	Standard polar	33892256
Chlorhexidine,4TMS,isomer #105	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4910.5	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #105	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3146.9	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #105	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7199.4	Standard polar	33892256
Chlorhexidine,4TMS,isomer #106	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4909.3	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #106	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3657.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #106	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7188.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #107	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4890.9	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #107	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3300.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #107	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7148.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #108	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4945.7	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #108	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3495.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #108	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	7240.7	Standard polar	33892256
Chlorhexidine,4TMS,isomer #109	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4916.2	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #109	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4056.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #109	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7230.3	Standard polar	33892256
Chlorhexidine,4TMS,isomer #11	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4802.0	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #11	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3272.5	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #11	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7246.0	Standard polar	33892256
Chlorhexidine,4TMS,isomer #110	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4951.1	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #110	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3018.8	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #110	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7245.7	Standard polar	33892256
Chlorhexidine,4TMS,isomer #12	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4807.1	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #12	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	2996.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #12	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7445.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #13	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4746.7	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #13	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3048.2	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #13	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7312.3	Standard polar	33892256
Chlorhexidine,4TMS,isomer #14	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4845.5	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #14	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3442.5	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #14	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7320.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #15	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4830.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #15	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3226.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #15	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7346.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #16	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4815.5	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #16	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3490.5	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #16	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7223.1	Standard polar	33892256
Chlorhexidine,4TMS,isomer #17	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4836.1	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #17	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3200.2	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #17	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7436.8	Standard polar	33892256
Chlorhexidine,4TMS,isomer #18	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4761.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #18	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3259.2	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #18	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7295.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #19	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4884.7	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #19	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3010.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #19	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7238.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #2	C[Si](C)(C)N=C(N(C(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4899.2	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #2	C[Si](C)(C)N=C(N(C(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3553.5	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #2	C[Si](C)(C)N=C(N(C(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7191.3	Standard polar	33892256
Chlorhexidine,4TMS,isomer #20	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4863.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #20	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3474.3	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #20	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7233.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #21	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4830.5	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #21	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3194.7	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #21	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7423.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #22	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4777.8	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #22	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3260.7	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #22	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7288.7	Standard polar	33892256
Chlorhexidine,4TMS,isomer #23	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4837.1	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #23	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3131.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #23	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7190.3	Standard polar	33892256
Chlorhexidine,4TMS,isomer #24	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4811.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #24	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	2992.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #24	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7433.7	Standard polar	33892256
Chlorhexidine,4TMS,isomer #25	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4766.1	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #25	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3057.5	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #25	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7309.0	Standard polar	33892256
Chlorhexidine,4TMS,isomer #26	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4843.8	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #26	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3113.2	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #26	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7269.7	Standard polar	33892256
Chlorhexidine,4TMS,isomer #27	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4781.7	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #27	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3317.9	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #27	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7187.1	Standard polar	33892256
Chlorhexidine,4TMS,isomer #28	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4821.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #28	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	2915.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #28	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7234.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #29	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4865.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #29	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3418.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #29	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7144.1	Standard polar	33892256
Chlorhexidine,4TMS,isomer #3	C[Si](C)(C)N=C(N(C(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4850.8	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #3	C[Si](C)(C)N=C(N(C(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3575.2	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #3	C[Si](C)(C)N=C(N(C(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7154.7	Standard polar	33892256
Chlorhexidine,4TMS,isomer #30	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4818.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #30	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3549.7	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #30	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7230.7	Standard polar	33892256
Chlorhexidine,4TMS,isomer #31	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4815.7	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #31	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3336.8	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #31	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7260.8	Standard polar	33892256
Chlorhexidine,4TMS,isomer #32	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4810.2	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #32	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3591.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #32	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7129.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #33	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4821.0	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #33	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3301.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #33	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7353.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #34	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4734.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #34	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3365.8	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #34	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7205.8	Standard polar	33892256
Chlorhexidine,4TMS,isomer #35	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4843.9	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #35	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	3925.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #35	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	7294.8	Standard polar	33892256
Chlorhexidine,4TMS,isomer #36	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4857.3	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #36	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3665.7	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #36	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7326.0	Standard polar	33892256
Chlorhexidine,4TMS,isomer #37	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4819.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #37	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3952.5	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #37	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7188.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #38	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4867.0	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #38	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3624.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #38	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7422.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #39	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4745.0	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #39	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3678.9	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #39	C[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7271.4	Standard polar	33892256
Chlorhexidine,4TMS,isomer #4	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4847.3	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #4	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3348.8	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #4	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7191.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #40	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4848.8	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #40	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3460.8	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #40	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	7192.7	Standard polar	33892256
Chlorhexidine,4TMS,isomer #41	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4814.2	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #41	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3961.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #41	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7179.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #42	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4807.8	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #42	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3659.5	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #42	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7389.8	Standard polar	33892256
Chlorhexidine,4TMS,isomer #43	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4733.2	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #43	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3690.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #43	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7241.0	Standard polar	33892256
Chlorhexidine,4TMS,isomer #44	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4821.0	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #44	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3591.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #44	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7138.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #45	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4786.0	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #45	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3426.9	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #45	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7403.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #46	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4744.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #46	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3471.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #46	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7269.0	Standard polar	33892256
Chlorhexidine,4TMS,isomer #47	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4810.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #47	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3547.2	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #47	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	7223.5	Standard polar	33892256
Chlorhexidine,4TMS,isomer #48	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4739.2	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #48	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3739.5	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #48	C[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7129.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #49	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4845.0	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #49	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3385.3	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #49	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7302.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #5	C[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4837.1	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #5	C[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3610.5	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #5	C[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7051.0	Standard polar	33892256
Chlorhexidine,4TMS,isomer #50	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4831.7	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #50	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3165.5	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #50	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7328.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #51	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4819.5	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #51	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3434.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #51	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7206.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #52	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4835.8	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #52	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3143.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #52	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7418.4	Standard polar	33892256
Chlorhexidine,4TMS,isomer #53	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4760.2	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #53	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3224.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #53	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7277.8	Standard polar	33892256
Chlorhexidine,4TMS,isomer #54	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4827.1	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #54	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3167.9	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #54	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7315.1	Standard polar	33892256
Chlorhexidine,4TMS,isomer #55	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4824.5	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #55	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3656.3	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #55	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7315.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #56	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4781.8	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #56	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3383.9	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #56	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7498.3	Standard polar	33892256
Chlorhexidine,4TMS,isomer #57	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4738.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #57	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3418.1	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #57	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7367.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #58	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4809.3	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #58	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3318.3	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #58	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7270.3	Standard polar	33892256
Chlorhexidine,4TMS,isomer #59	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4771.9	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #59	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3164.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #59	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7504.7	Standard polar	33892256
Chlorhexidine,4TMS,isomer #6	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4857.8	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #6	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3303.8	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #6	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7287.0	Standard polar	33892256
Chlorhexidine,4TMS,isomer #60	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4731.5	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #60	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3231.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #60	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7384.0	Standard polar	33892256
Chlorhexidine,4TMS,isomer #61	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4810.5	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #61	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3288.7	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #61	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7347.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #62	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4856.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #62	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3396.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #62	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	7295.4	Standard polar	33892256
Chlorhexidine,4TMS,isomer #63	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4826.8	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #63	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3899.5	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #63	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7290.3	Standard polar	33892256
Chlorhexidine,4TMS,isomer #64	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4805.2	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #64	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3603.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #64	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7486.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #65	C[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4731.7	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #65	C[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3636.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #65	C[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7346.3	Standard polar	33892256
Chlorhexidine,4TMS,isomer #66	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4818.5	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #66	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3524.7	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #66	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7246.0	Standard polar	33892256
Chlorhexidine,4TMS,isomer #67	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4789.9	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #67	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3373.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #67	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7496.3	Standard polar	33892256
Chlorhexidine,4TMS,isomer #68	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4818.7	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #68	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3485.8	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #68	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	7328.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #69	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4835.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #69	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3384.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #69	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7129.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #7	C[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4770.3	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #7	C[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3383.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #7	C[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7131.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #70	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4808.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #70	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3129.9	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #70	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7407.7	Standard polar	33892256
Chlorhexidine,4TMS,isomer #71	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4856.2	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #71	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3457.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #71	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	7335.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #72	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4821.5	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #72	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3081.8	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #72	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7281.3	Standard polar	33892256
Chlorhexidine,4TMS,isomer #73	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4955.1	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #73	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3083.7	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #73	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7196.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #74	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4877.3	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #74	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3176.7	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #74	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7307.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #75	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4873.8	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #75	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3000.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #75	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7332.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #76	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4872.9	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #76	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3243.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #76	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7212.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #77	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4879.1	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #77	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	2976.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #77	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7421.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #78	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4927.9	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #78	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3562.1	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #78	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	7360.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #79	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4914.3	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #79	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3356.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #79	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7383.7	Standard polar	33892256
Chlorhexidine,4TMS,isomer #8	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4845.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #8	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3002.8	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #8	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7270.8	Standard polar	33892256
Chlorhexidine,4TMS,isomer #80	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4901.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #80	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3619.2	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #80	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	7262.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #81	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4928.3	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #81	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3309.7	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #81	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7475.8	Standard polar	33892256
Chlorhexidine,4TMS,isomer #82	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4904.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #82	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3135.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #82	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7278.5	Standard polar	33892256
Chlorhexidine,4TMS,isomer #83	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4891.8	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #83	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3617.1	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #83	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	7272.4	Standard polar	33892256
Chlorhexidine,4TMS,isomer #84	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4859.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #84	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3330.1	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #84	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7466.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #85	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4876.7	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #85	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3278.9	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #85	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	7229.8	Standard polar	33892256
Chlorhexidine,4TMS,isomer #86	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4847.0	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #86	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3130.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #86	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7476.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #87	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4872.1	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #87	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3264.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #87	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	7309.9	Standard polar	33892256
Chlorhexidine,4TMS,isomer #88	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4880.0	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #88	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3190.2	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #88	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7434.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #89	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4863.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #89	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3006.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #89	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7452.3	Standard polar	33892256
Chlorhexidine,4TMS,isomer #9	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4809.7	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #9	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3213.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #9	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7337.6	Standard polar	33892256
Chlorhexidine,4TMS,isomer #90	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4863.9	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #90	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3262.6	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #90	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7345.8	Standard polar	33892256
Chlorhexidine,4TMS,isomer #91	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4873.0	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #91	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	2978.3	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #91	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7538.7	Standard polar	33892256
Chlorhexidine,4TMS,isomer #92	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4869.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #92	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3006.9	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #92	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7441.8	Standard polar	33892256
Chlorhexidine,4TMS,isomer #93	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4878.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #93	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3479.4	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #93	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7448.1	Standard polar	33892256
Chlorhexidine,4TMS,isomer #94	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4829.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #94	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3207.5	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #94	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7616.5	Standard polar	33892256
Chlorhexidine,4TMS,isomer #95	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4848.6	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #95	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3146.3	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #95	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7402.2	Standard polar	33892256
Chlorhexidine,4TMS,isomer #96	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4821.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #96	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	2996.0	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #96	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7620.0	Standard polar	33892256
Chlorhexidine,4TMS,isomer #97	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4896.1	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #97	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3199.9	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #97	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7431.1	Standard polar	33892256
Chlorhexidine,4TMS,isomer #98	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4903.2	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #98	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3717.1	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #98	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7436.4	Standard polar	33892256
Chlorhexidine,4TMS,isomer #99	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4848.4	Semi standard non polar	33892256
Chlorhexidine,4TMS,isomer #99	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3414.3	Standard non polar	33892256
Chlorhexidine,4TMS,isomer #99	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7612.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #1	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4752.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #1	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3158.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #1	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6608.5	Standard polar	33892256
Chlorhexidine,5TMS,isomer #10	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4736.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #10	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3351.2	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #10	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	6941.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #100	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4791.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #100	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3003.1	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #100	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	6852.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #101	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4789.7	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #101	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3223.9	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #101	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6713.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #102	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4810.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #102	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	2979.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #102	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	6942.9	Standard polar	33892256
Chlorhexidine,5TMS,isomer #103	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4765.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #103	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	2903.2	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #103	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6889.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #104	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4770.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #104	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3284.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #104	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6880.5	Standard polar	33892256
Chlorhexidine,5TMS,isomer #105	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4741.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #105	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3050.9	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #105	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7076.2	Standard polar	33892256
Chlorhexidine,5TMS,isomer #106	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4767.3	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #106	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3009.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #106	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6846.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #107	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4733.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #107	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	2885.9	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #107	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7094.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #108	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4770.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #108	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3007.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #108	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6925.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #109	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4802.7	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #109	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3204.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #109	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6930.4	Standard polar	33892256
Chlorhexidine,5TMS,isomer #11	C[Si](C)(C)N=C(N(C(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4644.8	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #11	C[Si](C)(C)N=C(N(C(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3463.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #11	C[Si](C)(C)N=C(N(C(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6783.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #110	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4803.8	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #110	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3644.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #110	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6923.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #111	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4775.8	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #111	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3366.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #111	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7123.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #112	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4779.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #112	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3331.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #112	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6888.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #113	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4766.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #113	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3179.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #113	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7141.3	Standard polar	33892256
Chlorhexidine,5TMS,isomer #114	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4784.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #114	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3320.2	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #114	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6969.2	Standard polar	33892256
Chlorhexidine,5TMS,isomer #115	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4789.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #115	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3242.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #115	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6750.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #116	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4750.1	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #116	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3007.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #116	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7049.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #117	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4763.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #117	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	2895.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #117	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7012.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #118	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4763.7	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #118	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3289.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #118	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7008.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #119	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4731.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #119	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3046.2	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #119	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7194.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #12	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4731.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #12	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3184.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #12	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6727.2	Standard polar	33892256
Chlorhexidine,5TMS,isomer #120	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4740.3	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #120	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3010.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #120	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	6972.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #121	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4724.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #121	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	2876.8	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #121	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7206.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #122	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4758.8	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #122	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3102.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #122	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	6941.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #123	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4768.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #123	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3295.1	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #123	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	6912.9	Standard polar	33892256
Chlorhexidine,5TMS,isomer #124	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4807.3	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #124	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3133.3	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #124	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6713.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #125	C[Si](C)(C)N=C(N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4805.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #125	C[Si](C)(C)N=C(N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3585.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #125	C[Si](C)(C)N=C(N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6691.9	Standard polar	33892256
Chlorhexidine,5TMS,isomer #126	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4788.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #126	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3251.3	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #126	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6664.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #13	C[Si](C)(C)N=C(N(C(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4728.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #13	C[Si](C)(C)N=C(N(C(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3657.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #13	C[Si](C)(C)N=C(N(C(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6705.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #14	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4692.8	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #14	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3364.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #14	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	6922.5	Standard polar	33892256
Chlorhexidine,5TMS,isomer #15	C[Si](C)(C)N=C(N(C(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4647.1	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #15	C[Si](C)(C)N=C(N(C(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3464.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #15	C[Si](C)(C)N=C(N(C(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6770.4	Standard polar	33892256
Chlorhexidine,5TMS,isomer #16	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4714.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #16	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3303.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #16	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6678.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #17	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4690.8	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #17	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3145.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #17	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	6950.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #18	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4631.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #18	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3258.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #18	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6810.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #19	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4713.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #19	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3281.9	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #19	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6763.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #2	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4688.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #2	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3220.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #2	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6739.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #20	C[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4652.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #20	C[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3523.3	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #20	C[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6663.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #21	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4659.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #21	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3111.1	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #21	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6733.2	Standard polar	33892256
Chlorhexidine,5TMS,isomer #22	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4703.8	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #22	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3092.8	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #22	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6914.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #23	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4687.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #23	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	2928.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #23	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	6950.5	Standard polar	33892256
Chlorhexidine,5TMS,isomer #24	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4680.7	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #24	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3138.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #24	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6822.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #25	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4691.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #25	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	2914.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #25	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7038.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #26	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4614.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #26	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	2981.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #26	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6894.9	Standard polar	33892256
Chlorhexidine,5TMS,isomer #27	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4697.1	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #27	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	2922.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #27	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6926.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #28	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4690.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #28	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3312.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #28	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6916.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #29	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4662.7	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #29	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3072.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #29	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7107.4	Standard polar	33892256
Chlorhexidine,5TMS,isomer #3	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4689.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #3	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3038.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #3	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	6784.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #30	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4608.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #30	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3141.3	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #30	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6973.2	Standard polar	33892256
Chlorhexidine,5TMS,isomer #31	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4675.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #31	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3021.3	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #31	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6883.4	Standard polar	33892256
Chlorhexidine,5TMS,isomer #32	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4662.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #32	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	2894.9	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #32	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7123.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #33	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4601.7	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #33	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	2964.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #33	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7000.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #34	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4686.1	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #34	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3011.9	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #34	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6960.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #35	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4605.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #35	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3200.8	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #35	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6875.2	Standard polar	33892256
Chlorhexidine,5TMS,isomer #36	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4629.1	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #36	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	2857.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #36	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6931.3	Standard polar	33892256
Chlorhexidine,5TMS,isomer #37	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4721.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #37	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3099.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #37	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6897.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #38	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4715.3	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #38	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3534.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #38	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6885.2	Standard polar	33892256
Chlorhexidine,5TMS,isomer #39	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4683.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #39	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3267.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #39	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7086.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #4	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4687.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #4	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3265.9	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #4	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6642.3	Standard polar	33892256
Chlorhexidine,5TMS,isomer #40	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4634.8	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #40	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3343.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #40	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6945.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #41	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4691.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #41	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3206.9	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #41	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6852.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #42	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4667.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #42	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3072.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #42	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7106.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #43	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4614.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #43	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3147.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #43	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6975.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #44	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4698.1	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #44	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3191.9	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #44	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6933.5	Standard polar	33892256
Chlorhexidine,5TMS,isomer #45	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4631.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #45	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3407.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #45	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6842.4	Standard polar	33892256
Chlorhexidine,5TMS,isomer #46	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4646.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #46	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3023.9	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #46	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6901.2	Standard polar	33892256
Chlorhexidine,5TMS,isomer #47	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4726.8	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #47	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3097.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #47	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6717.3	Standard polar	33892256
Chlorhexidine,5TMS,isomer #48	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4689.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #48	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	2901.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #48	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7013.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #49	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4642.8	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #49	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	2985.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #49	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6878.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #5	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4692.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #5	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3009.9	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #5	C[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	6875.4	Standard polar	33892256
Chlorhexidine,5TMS,isomer #50	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4731.1	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #50	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3182.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #50	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6930.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #51	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4651.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #51	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3392.1	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #51	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6855.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #52	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4694.7	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #52	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	2881.2	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #52	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6890.4	Standard polar	33892256
Chlorhexidine,5TMS,isomer #53	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4606.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #53	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3111.2	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #53	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6810.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #54	C[Si](C)(C)N=C(N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4715.1	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #54	C[Si](C)(C)N=C(N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3495.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #54	C[Si](C)(C)N=C(N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6749.3	Standard polar	33892256
Chlorhexidine,5TMS,isomer #55	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4705.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #55	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3285.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #55	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	6797.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #56	C[Si](C)(C)N=C(N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4706.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #56	C[Si](C)(C)N=C(N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3534.8	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #56	C[Si](C)(C)N=C(N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6649.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #57	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4711.3	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #57	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3257.1	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #57	C[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	6890.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #58	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4621.3	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #58	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3370.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #58	C[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6728.3	Standard polar	33892256
Chlorhexidine,5TMS,isomer #59	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4681.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #59	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3185.1	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #59	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6808.3	Standard polar	33892256
Chlorhexidine,5TMS,isomer #6	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4599.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #6	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3088.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #6	C[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6721.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #60	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4705.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #60	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3635.2	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #60	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6794.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #61	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4649.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #61	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3364.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #61	C[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7001.5	Standard polar	33892256
Chlorhexidine,5TMS,isomer #62	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4610.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #62	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3456.8	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #62	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6854.3	Standard polar	33892256
Chlorhexidine,5TMS,isomer #63	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4678.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #63	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3313.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #63	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6763.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #64	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4647.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #64	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3157.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #64	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7025.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #65	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4589.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #65	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3267.1	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #65	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6888.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #66	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4676.3	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #66	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3292.2	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #66	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6844.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #67	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4617.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #67	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3509.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #67	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6749.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #68	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4722.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #68	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3492.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #68	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6853.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #69	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4739.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #69	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3975.8	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #69	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6837.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #7	C[Si](C)(C)N=C(N(C(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4734.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #7	C[Si](C)(C)N=C(N(C(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3618.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #7	C[Si](C)(C)N=C(N(C(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6804.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #70	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4695.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #70	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3683.8	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #70	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7053.9	Standard polar	33892256
Chlorhexidine,5TMS,isomer #71	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4643.7	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #71	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3752.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #71	C[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6899.2	Standard polar	33892256
Chlorhexidine,5TMS,isomer #72	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4715.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #72	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3620.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #72	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6808.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #73	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4678.9	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #73	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3450.8	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #73	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7078.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #74	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4621.3	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #74	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3545.2	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #74	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6937.9	Standard polar	33892256
Chlorhexidine,5TMS,isomer #75	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4711.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #75	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3586.2	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #75	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6893.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #76	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4646.1	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #76	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3804.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #76	C[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6792.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #77	C[Si](C)(C)N=C(N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4706.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #77	C[Si](C)(C)N=C(N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3520.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #77	C[Si](C)(C)N=C(N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6648.2	Standard polar	33892256
Chlorhexidine,5TMS,isomer #78	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4652.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #78	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3267.1	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #78	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	6965.2	Standard polar	33892256
Chlorhexidine,5TMS,isomer #79	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4619.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #79	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3372.2	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #79	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6820.0	Standard polar	33892256
Chlorhexidine,5TMS,isomer #8	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4727.1	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #8	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3392.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #8	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	6849.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #80	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4709.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #80	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3596.8	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #80	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6877.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #81	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4673.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #81	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3230.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #81	C[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6836.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #82	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4718.8	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #82	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3053.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #82	C[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6875.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #83	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4709.7	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #83	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3476.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #83	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6863.5	Standard polar	33892256
Chlorhexidine,5TMS,isomer #84	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4678.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #84	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3212.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #84	C[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7065.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #85	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4631.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #85	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3306.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #85	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6922.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #86	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4691.1	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #86	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3154.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #86	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6831.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #87	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4665.5	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #87	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3019.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #87	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7085.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #88	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4611.8	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #88	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3109.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #88	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6954.3	Standard polar	33892256
Chlorhexidine,5TMS,isomer #89	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	4696.3	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #89	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	3143.2	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #89	C[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)N(CCCCCCNC(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C	6912.9	Standard polar	33892256
Chlorhexidine,5TMS,isomer #9	C[Si](C)(C)N=C(N(C(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4723.3	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #9	C[Si](C)(C)N=C(N(C(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3655.0	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #9	C[Si](C)(C)N=C(N(C(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6705.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #90	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4699.3	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #90	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3245.5	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #90	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6797.7	Standard polar	33892256
Chlorhexidine,5TMS,isomer #91	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4655.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #91	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3018.3	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #91	C[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C)NC(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7084.8	Standard polar	33892256
Chlorhexidine,5TMS,isomer #92	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4695.0	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #92	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	3330.1	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #92	C[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	7009.3	Standard polar	33892256
Chlorhexidine,5TMS,isomer #93	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	4673.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #93	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	2992.3	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #93	C[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C	6965.6	Standard polar	33892256
Chlorhexidine,5TMS,isomer #94	C[Si](C)(C)N=C(N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4716.2	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #94	C[Si](C)(C)N=C(N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3451.8	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #94	C[Si](C)(C)N=C(N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6755.5	Standard polar	33892256
Chlorhexidine,5TMS,isomer #95	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	4670.7	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #95	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	3210.6	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #95	C[Si](C)(C)N=C(NC(=N[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)NC1=CC=C(Cl)C=C1	7062.1	Standard polar	33892256
Chlorhexidine,5TMS,isomer #96	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4719.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #96	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3527.9	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #96	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6980.3	Standard polar	33892256
Chlorhexidine,5TMS,isomer #97	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	4681.6	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #97	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	3166.7	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #97	C[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)N(C(=N[Si](C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C	6937.4	Standard polar	33892256
Chlorhexidine,5TMS,isomer #98	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4717.3	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #98	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3072.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #98	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6789.5	Standard polar	33892256
Chlorhexidine,5TMS,isomer #99	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	4798.4	Semi standard non polar	33892256
Chlorhexidine,5TMS,isomer #99	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	3168.4	Standard non polar	33892256
Chlorhexidine,5TMS,isomer #99	C[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C	6810.0	Standard polar	33892256
Chlorhexidine,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N(C(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1	5560.6	Semi standard non polar	33892256
Chlorhexidine,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N(C(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1	4185.0	Standard non polar	33892256
Chlorhexidine,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N(C(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1	8650.5	Standard polar	33892256
Chlorhexidine,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC1=CC=C(Cl)C=C1	5660.6	Semi standard non polar	33892256
Chlorhexidine,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC1=CC=C(Cl)C=C1	4154.2	Standard non polar	33892256
Chlorhexidine,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC1=CC=C(Cl)C=C1	8652.8	Standard polar	33892256
Chlorhexidine,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC1=CC=C(Cl)C=C1	5630.6	Semi standard non polar	33892256
Chlorhexidine,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC1=CC=C(Cl)C=C1	4514.3	Standard non polar	33892256
Chlorhexidine,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC1=CC=C(Cl)C=C1	8543.7	Standard polar	33892256
Chlorhexidine,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	5645.4	Semi standard non polar	33892256
Chlorhexidine,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	4213.1	Standard non polar	33892256
Chlorhexidine,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	8553.8	Standard polar	33892256
Chlorhexidine,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	5595.2	Semi standard non polar	33892256
Chlorhexidine,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4475.2	Standard non polar	33892256
Chlorhexidine,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	8691.1	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5619.8	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3769.5	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7756.2	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5596.9	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3980.5	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7760.9	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5622.1	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	3787.5	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7827.0	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5573.7	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	4135.3	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7888.2	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5577.8	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	4158.7	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7883.5	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	5629.5	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	3841.7	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	7832.3	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5571.7	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	4213.9	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7764.1	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC1=CC=C(Cl)C=C1	5625.0	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC1=CC=C(Cl)C=C1	3746.2	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC1=CC=C(Cl)C=C1	7926.8	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5599.4	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4007.2	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7677.6	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5591.6	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4527.6	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7773.8	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	5533.1	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4527.4	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	7710.5	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5517.5	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4301.4	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7717.8	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5582.3	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4296.1	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7664.5	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	5523.0	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	4563.1	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	7575.5	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5640.0	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3873.8	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7760.8	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5580.5	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4238.7	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7784.8	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	5637.0	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	3941.7	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	7737.8	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	5541.4	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4491.0	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	7839.4	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5552.0	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3941.9	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7758.9	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5482.6	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4207.5	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7820.8	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	5480.7	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4202.4	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	7806.6	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5559.4	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3951.1	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7753.3	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	5461.9	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	4246.1	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	7680.6	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5551.5	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	3901.7	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7851.3	Standard polar	33892256
Chlorhexidine,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N(C(=N)NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C1=CC=C(Cl)C=C1	5430.1	Semi standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N(C(=N)NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C1=CC=C(Cl)C=C1	3869.3	Standard non polar	33892256
Chlorhexidine,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N(C(=N)NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C1=CC=C(Cl)C=C1	7774.3	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5565.1	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4086.6	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N=C(N(C(=N)NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7079.8	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5546.5	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4434.1	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)C(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	7169.3	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	5465.2	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4432.9	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	7134.4	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5520.2	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4168.5	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7136.0	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	5441.8	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	4471.0	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)NC1=CC=C(Cl)C=C1	7033.1	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5514.7	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	4116.9	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7224.3	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5405.7	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4152.8	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7113.6	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5523.6	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3815.4	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7187.5	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5474.0	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4070.9	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7225.9	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5525.0	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3801.9	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7224.0	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5455.9	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4116.3	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7129.3	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5571.4	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3604.0	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7202.7	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5521.9	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3745.7	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7307.7	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5430.9	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3795.6	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7206.4	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	5449.2	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4345.8	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)N(CCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	7233.4	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5484.2	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4075.8	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7232.2	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5416.1	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4384.6	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7133.4	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5483.2	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	4023.3	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7319.7	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5379.7	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4049.5	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7211.7	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5520.6	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3814.5	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	7173.7	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5484.0	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4379.9	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7153.9	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5469.2	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	4008.0	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7312.4	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5534.7	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3902.6	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7210.7	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5465.3	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3936.1	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7110.4	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5519.3	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	3711.4	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7299.3	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5476.9	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3887.0	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	7190.2	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5596.1	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3580.4	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7178.5	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5633.9	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4061.6	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	7233.5	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5531.0	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4071.5	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	7210.2	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5568.1	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3798.2	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #36	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7210.2	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #37	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5514.2	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #37	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4126.9	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #37	CC(C)(C)[Si](C)(C)N=C(NC1=CC=C(Cl)C=C1)N(C(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	7111.2	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5562.8	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	3719.5	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #38	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7296.0	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N=C(NC(=N[Si](C)(C)C(C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5602.6	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N=C(NC(=N[Si](C)(C)C(C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	3569.6	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #39	CC(C)(C)[Si](C)(C)N=C(NC(=N[Si](C)(C)C(C)(C)C)N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7282.6	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5530.8	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3899.6	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7198.2	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #40	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5553.6	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #40	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	3857.4	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #40	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7319.2	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	5564.1	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	3580.0	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #41	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N)NC1=CC=C(Cl)C=C1	7311.4	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #42	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5546.5	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #42	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	3922.8	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #42	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7227.4	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #43	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5569.9	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #43	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	3501.7	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #43	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7392.9	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #44	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5528.2	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #44	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	4179.6	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #44	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7333.3	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #45	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5550.9	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #45	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3879.5	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #45	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7327.0	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #46	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5504.7	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #46	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	4226.7	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #46	CC(C)(C)[Si](C)(C)N=C(NC(=N)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7237.7	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #47	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5549.1	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #47	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	3787.8	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #47	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)NC(=N[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7411.4	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #48	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5611.6	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #48	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	3599.1	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #48	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7280.4	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #49	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5594.7	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #49	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	4212.6	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #49	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7266.4	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5590.4	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3625.2	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7199.5	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #50	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5562.1	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #50	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	3734.2	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #50	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7220.1	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #51	CC(C)(C)[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5610.6	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #51	CC(C)(C)[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4030.6	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #51	CC(C)(C)[Si](C)(C)N=C(N(CCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7075.1	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #52	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5519.2	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #52	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4101.4	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #52	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7130.0	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #53	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5567.6	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #53	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3819.2	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #53	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7132.2	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #54	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5506.4	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #54	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4154.3	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #54	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7030.2	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #55	CC(C)(C)[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	5564.2	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #55	CC(C)(C)[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	4608.8	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #55	CC(C)(C)[Si](C)(C)N(CCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C(=N)NC(=N)NC1=CC=C(Cl)C=C1	7175.5	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #56	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5595.7	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #56	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	4319.3	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #56	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7176.9	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #57	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5538.7	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #57	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	4650.5	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #57	CC(C)(C)[Si](C)(C)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)C(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7073.6	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #58	CC(C)(C)[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5545.5	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #58	CC(C)(C)[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4009.1	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #58	CC(C)(C)[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	7092.6	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #59	CC(C)(C)[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5574.8	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #59	CC(C)(C)[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	3956.7	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #59	CC(C)(C)[Si](C)(C)N=C(NC(=N)NC1=CC=C(Cl)C=C1)N(CCCCCCN(C(=N)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	7192.3	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5500.9	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3944.9	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)N(C(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7099.8	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #60	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	5609.5	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #60	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	3668.1	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #60	CC(C)(C)[Si](C)(C)N=C(NCCCCCCN(C(=N[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC(=N)NC1=CC=C(Cl)C=C1	7193.7	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	5584.7	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	3578.3	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)NC1=CC=C(Cl)C=C1	7284.6	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	5488.7	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	3658.4	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)N=C(NC(=N)NCCCCCCNC(=N)NC(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C	7180.8	Standard polar	33892256
Chlorhexidine,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	5529.2	Semi standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	4008.6	Standard non polar	33892256
Chlorhexidine,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)N=C(NCCCCCCNC(=N)NC(=N)NC1=CC=C(Cl)C=C1)N(C(=N)N(C1=CC=C(Cl)C=C1)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	7112.5	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Chlorhexidine GC-MS (Non-derivatized) - 70eV, Positive	splash10-00di-1390000000-e2087e07b387187b35e2	2017-09-01	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Experimental LC-MS/MS	LC-MS/MS Spectrum - Chlorhexidine LC-ESI-qTof , Positive-QTOF	splash10-00yi-2912000000-109a5810a9e5d36f3105	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Chlorhexidine , positive-QTOF	splash10-0ufr-2900000000-77fb2c1a85c1b39d8e91	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Chlorhexidine , positive-QTOF	splash10-00yi-2912000000-109a5810a9e5d36f3105	2017-09-14	HMDB team, MONA	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Chlorhexidine 10V, Positive-QTOF	splash10-0a4i-0624090000-0824436f86a1c2a4784b	2016-06-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Chlorhexidine 20V, Positive-QTOF	splash10-0fk9-0922000000-b6c796459e4397e81075	2016-06-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Chlorhexidine 40V, Positive-QTOF	splash10-0229-2940000000-ba95a6a3988436fdde57	2016-06-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Chlorhexidine 10V, Negative-QTOF	splash10-0udi-0825090000-0c29f46fa3cd4527a699	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Chlorhexidine 20V, Negative-QTOF	splash10-0hk9-0943010000-331d57f140196db7cca5	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Chlorhexidine 40V, Negative-QTOF	splash10-004i-2920000000-1106ffe675713cb3aa8b	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Chlorhexidine 10V, Positive-QTOF	splash10-0pb9-0005090000-664161779948ab5a38f2	2021-10-11	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Chlorhexidine 20V, Positive-QTOF	splash10-0udi-0019110000-4b9e646f6af71a04c7f4	2021-10-11	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Chlorhexidine 40V, Positive-QTOF	splash10-0zfu-0911000000-c1d04b690ccaba255142	2021-10-11	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Chlorhexidine 10V, Negative-QTOF	splash10-0udi-7009080000-6a3e8465c5ed8d7a41f6	2021-10-11	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Chlorhexidine 20V, Negative-QTOF	splash10-0udi-5911110000-3b9f2c76df72c8f813cf	2021-10-11	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Chlorhexidine 40V, Negative-QTOF	splash10-001i-9201100000-c66d3bc503e1b781ebd8	2021-10-11	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm

Biospecimen Locations

Blood
Saliva
Urine

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Expected but not Quantified	Not Quantified	Not Available	Not Available	Taking drug identified by DrugBank entry DB00878	21059682	details
Saliva	Detected but not Quantified	Not Quantified	Adult (>18 years old)	Not Specified	Normal	12097436	details
Urine	Expected but not Quantified	Not Quantified	Not Available	Not Available	Taking drug identified by DrugBank entry DB00878	21059682	details

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

DB00878

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

2612

KEGG Compound ID

C06902

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Chlorhexidine

METLIN ID

Not Available

PubChem Compound

2713

PDB ID

Not Available

ChEBI ID

3614

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

rw1317991

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Not Available

Enzymes

Enzyme Details

1. Histamine N-methyltransferase

General function:: Involved in histamine N-methyltransferase activity
Specific function:: Inactivates histamine by N-methylation. Plays an important role in degrading histamine and in regulating the airway response to histamine.
Gene Name:: HNMT
Uniprot ID:: P50135
Molecular weight:: 6045.9

References

Harle DG, Baldo BA: Structural features of potent inhibitors of rat kidney histamine N-methyltransferase. Biochem Pharmacol. 1988 Feb 1;37(3):385-8. [PubMed:3337739 ]

Showing metabocard for Chlorhexidine (HMDB0015016)

MOL for HMDB0015016 (Chlorhexidine)

3D MOL for HMDB0015016 (Chlorhexidine)

3D SDF for HMDB0015016 (Chlorhexidine)

3D-SDF for HMDB0015016 (Chlorhexidine)

PDB for HMDB0015016 (Chlorhexidine)

3D PDB for HMDB0015016 (Chlorhexidine)

SMILES for HMDB0015016 (Chlorhexidine)

INCHI for HMDB0015016 (Chlorhexidine)

Structure for HMDB0015016 (Chlorhexidine)

3D Structure for HMDB0015016 (Chlorhexidine)

Experimental Collision Cross Sections

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

Enzymes

References