Molecule

ID:104356

General Information
Structure
MolImage
Molecular Formula
C₂H₆N₂S
Molecular Mass
90.14744
Exact Mass
90.0251692
Charge
0
InChI
InChI=1S/C2H6N2S/c1-4-2(3)5/h1H3,(H3,3,4,5)
InChIKey
KQJQICVXLJTWQD-UHFFFAOYSA-N
Canonic Smiles
CNC(=N)S
Isomeric Smiles
CNC(=N)S
Calculated Properties
JChem
Acid pKa
3.1779683
H Acceptors
2
H Donor
3
LogD (pH = 5.5)
0.9435577
LogD (pH = 7.4)
0.9455939
Log P
0.9456188
Molar Refractivity
35.1029
Polarizability
9.365997
Polar Surface Area
35.88
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
No Data Available
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Molecule Details
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References
Bioactivity
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