Molecule

ID:37504

General Information
Structure
MolImage
Molecular Formula
C₃Cl₂S₃
Molecular Mass
203.1331
Exact Mass
201.85391836
Charge
0
InChI
InChI=1S/C3Cl2S3/c4-1-2(5)7-8-3(1)6
InChIKey
YFFQMIVUPGFPBF-UHFFFAOYSA-N
Canonic Smiles
Clc1ssc(=S)c1Cl
Isomeric Smiles
c1(c(ssc1=S)Cl)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.8507478
LogD (pH = 7.4)
3.8507478
Log P
3.8507478
Molar Refractivity
56.8983
Polarizability
18.664211
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
Molecule Details
References
Bioactivity
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