Molecule

ID:57474

General Information
Structure
MolImage
Molecular Formula
C₅H₁₀O₃S
Molecular Mass
150.1961
Exact Mass
150.03506518
Charge
0
InChI
InChI=1S/C5H10O3S/c6-5-1-3-9(7,8)4-2-5/h5-6H,1-4H2
InChIKey
JABSMKPYEZTJTE-UHFFFAOYSA-N
Canonic Smiles
OC1CCS(=O)(=O)CC1
Isomeric Smiles
C1C(CCS(=O)(=O)C1)O
Calculated Properties
JChem
Acid pKa
15.172884
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
-1.6785337
LogD (pH = 7.4)
-1.6785337
Log P
-1.6785337
Molar Refractivity
34.0913
Polarizability
14.098563
Polar Surface Area
54.37
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
References
Bioactivity
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