Molecule

ID:9393

General Information
Structure
MolImage
Molecular Formula
C₄H₂Cl₂S
Molecular Mass
153.02968
Exact Mass
151.92542642
Charge
0
InChI
InChI=1S/C4H2Cl2S/c5-3-1-2-4(6)7-3/h1-2H
InChIKey
FGYBDASKYMSNCX-UHFFFAOYSA-N
Canonic Smiles
Clc1ccc(s1)Cl
Isomeric Smiles
c1cc(sc1Cl)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.2937691
LogD (pH = 7.4)
3.2937691
Log P
3.2937691
Molar Refractivity
31.0932
Polarizability
12.948438
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
No Data Available
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Molecule Details
References
Bioactivity
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