Molecule

ID:43808

General Information
Structure
MolImage
Molecular Formula
C₃HCl₂NS
Molecular Mass
154.01774
Exact Mass
152.9206754
Charge
0
InChI
InChI=1S/C3HCl2NS/c4-2-1-7-3(5)6-2/h1H
InChIKey
ICETWLGKJXCIDX-UHFFFAOYSA-N
Canonic Smiles
Clc1scc(n1)Cl
Isomeric Smiles
n1c(scc1Cl)Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.3702748
LogD (pH = 7.4)
2.3702748
Log P
2.3702748
Molar Refractivity
32.1584
Polarizability
12.242207
Polar Surface Area
12.89
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
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References
Bioactivity
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