Molecule

ID:67411

General Information
Structure
MolImage
Molecular Formula
C₂HClN₂S
Molecular Mass
120.56074
Exact Mass
119.95489672
Charge
0
InChI
InChI=1S/C2HClN2S/c3-2-4-1-5-6-2/h1H
InChIKey
RZKVGQCJNANFDR-UHFFFAOYSA-N
Canonic Smiles
Clc1ncns1
Isomeric Smiles
s1ncnc1Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.2470586
LogD (pH = 7.4)
1.2470589
Log P
1.2470589
Molar Refractivity
26.1056
Polarizability
9.449482
Polar Surface Area
25.78
Rotatable Bonds
0
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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