Molecule

ID:69812

General Information
Structure
MolImage
Molecular Formula
C₂H₇NO₂S
Molecular Mass
109.14748
Exact Mass
109.01974947
Charge
0
InChI
InChI=1S/C2H7NO2S/c1-2-6(3,4)5/h2H2,1H3,(H2,3,4,5)
InChIKey
ZCRZCMUDOWDGOB-UHFFFAOYSA-N
Canonic Smiles
CCS(=O)(=O)N
Isomeric Smiles
C(C)S(=O)(=O)N
Calculated Properties
JChem
Acid pKa
12.804336
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-1.0262524
LogD (pH = 7.4)
-1.0262538
Log P
-1.0262524
Molar Refractivity
22.9393
Polarizability
9.828679
Polar Surface Area
60.16
Rotatable Bonds
1
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
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Molecule Details
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References
Bioactivity
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