Molecule
ID:129856
General Information
Molecular Formula
C₃H₄S
Molecular Mass
72.12886
Exact Mass
72.00337113
Charge
0
InChI
InChI=1S/C3H4S/c1-2-4-3-1/h1-2H,3H2
InChIKey
HPINPCFOKNNWNW-UHFFFAOYSA-N
Canonic Smiles
C1SC=C1
Isomeric Smiles
C1C=CS1
Calculated Properties
JChem
Acid pKa
13.249575
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
0.860878
LogD (pH = 7.4)
0.8608774
Log P
0.860878
Molar Refractivity
22.061
Polarizability
8.362746
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
No Data Available
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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
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Bioactivity
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