Molecule

ID:69502

General Information
Structure
MolImage
Molecular Formula
C₂H₇NO₂S
Molecular Mass
109.14748
Exact Mass
109.01974947
Charge
0
InChI
InChI=1S/C2H7NO2S/c1-3-6(2,4)5/h3H,1-2H3
InChIKey
UHNHTTIUNATJKL-UHFFFAOYSA-N
Canonic Smiles
CNS(=O)(=O)C
Isomeric Smiles
CS(=O)(=O)NC
Calculated Properties
JChem
Acid pKa
13.107097
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-1.3115735
LogD (pH = 7.4)
-1.3115742
Log P
-1.3115735
Molar Refractivity
22.9636
Polarizability
9.828679
Polar Surface Area
46.17
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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