Molecule

ID:31763

General Information
Structure
MolImage
Molecular Formula
C₄H₁₀ClNO₂S
Molecular Mass
171.6457
Exact Mass
171.01207725
Charge
0
InChI
InChI=1S/C4H10ClNO2S/c1-3-6(4-2)9(5,7)8/h3-4H2,1-2H3
InChIKey
NDYAAZRKZRTLQC-UHFFFAOYSA-N
Canonic Smiles
CCN(S(=O)(=O)Cl)CC
Isomeric Smiles
S(=O)(=O)(N(CC)CC)Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
0.5099364
LogD (pH = 7.4)
0.5099364
Log P
0.5099364
Molar Refractivity
38.1685
Polarizability
15.433956
Polar Surface Area
37.38
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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