Molecule

ID:123031

General Information
Structure
MolImage
Molecular Formula
C₂H₃NS
Molecular Mass
73.11692
Exact Mass
72.9986201
Charge
0
InChI
InChI=1S/C2H3NS/c1-3-2-4/h1H3
InChIKey
LGDSHSYDSCRFAB-UHFFFAOYSA-N
Canonic Smiles
CN=C=S
Isomeric Smiles
C(=S)=NC
Calculated Properties
JChem
LogD (pH = 7.4)
1.07
LogD (pH = 5.5)
1.07
Log P
1.07
Rotatable Bonds
0
H Donor
0
H Acceptors
1
Lipinski's Rule of Five
true
Acid pKa
1.47
Polar Surface Area
12.36
Polarizability
7.20
Molar Refractivity
21.33
LOG S
-0.80
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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