Molecule

ID:129679

General Information
Structure
Molecular Formula
C₃H₆OS
Molecular Mass
90.14414
Exact Mass
90.01393581
Charge
0
InChI
InChI=1S/C3H6OS/c1-2-3-5-4/h3H,2H2,1H3
InChIKey
BAZSXBOAXJLRNH-UHFFFAOYSA-N
Canonic Smiles
CCC=S=O
Isomeric Smiles
O=S=CCC
Calculated Properties
JChem
LogD (pH = 7.4)
1.15
LogD (pH = 5.5)
1.15
Log P
1.15
Rotatable Bonds
1
H Donor
0
H Acceptors
1
Lipinski's Rule of Five
true
Polar Surface Area
17.07
Polarizability
9.14
Molar Refractivity
22.16
LOG S
-1.61
Data Source
Names and Identifiers
Registration numbers
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
References
Bioactivity
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