Molecule

ID:91126

General Information
Structure
MolImage
Molecular Formula
C₅H₅ClS
Molecular Mass
132.6112
Exact Mass
131.98004884
Charge
0
InChI
InChI=1S/C5H5ClS/c6-3-5-1-2-7-4-5/h1-2,4H,3H2
InChIKey
KKWWFYAKOFXBEY-UHFFFAOYSA-N
Canonic Smiles
ClCc1cscc1
Isomeric Smiles
s1ccc(c1)CCl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.3409297
LogD (pH = 7.4)
2.3409297
Log P
2.3409297
Molar Refractivity
33.0307
Polarizability
12.664002
Polar Surface Area
0.0
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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