Molecule

ID:10357

General Information
Structure
MolImage
Molecular Formula
C₄HCl₃O₂S₂
Molecular Mass
251.53854
Exact Mass
249.84835431
Charge
0
InChI
InChI=1S/C4HCl3O2S2/c5-3-1-2(4(6)10-3)11(7,8)9/h1H
InChIKey
JJKSHSHZJOWSEC-UHFFFAOYSA-N
Canonic Smiles
Clc1sc(c(c1)S(=O)(=O)Cl)Cl
Isomeric Smiles
s1c(c(cc1Cl)S(=O)(=O)Cl)Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
3.240072
LogD (pH = 7.4)
3.240072
Log P
3.240072
Molar Refractivity
45.2874
Polarizability
19.335276
Polar Surface Area
34.14
Rotatable Bonds
1
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
No Data Available
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Molecule Details
References
Bioactivity
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