Molecule

ID:113259

General Information
Structure
MolImage
Molecular Formula
C₄H₁₀N₂O₂S
Molecular Mass
150.1994
Exact Mass
150.04629857
Charge
0
InChI
InChI=1S/C4H10N2O2S/c5-6-4-1-2-9(7,8)3-4/h4,6H,1-3,5H2
InChIKey
DBBOTJJFLMUEIN-UHFFFAOYSA-N
Canonic Smiles
NNC1CCS(=O)(=O)C1
Isomeric Smiles
S1(=O)(=O)CC(CC1)NN
Calculated Properties
JChem
H Acceptors
4
H Donor
2
LogD (pH = 5.5)
-2.113107
LogD (pH = 7.4)
-2.031179
Log P
-2.0300307
Molar Refractivity
45.4467
Polarizability
14.463603
Polar Surface Area
72.19
Rotatable Bonds
1
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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