Molecule

ID:63527

General Information
Structure
MolImage
Molecular Formula
C₅H₇NS
Molecular Mass
113.18078
Exact Mass
113.02992023
Charge
0
InChI
InChI=1S/C5H7NS/c1-4-2-5(6)7-3-4/h2-3H,6H2,1H3
InChIKey
HIJCUWLXJWHXCN-UHFFFAOYSA-N
Canonic Smiles
Cc1csc(c1)N
Isomeric Smiles
c1(N)cc(C)cs1
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
1.6041787
LogD (pH = 7.4)
1.6041791
Log P
1.6041791
Molar Refractivity
32.0653
Polarizability
11.870009
Polar Surface Area
26.02
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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