Molecule

ID:878

General Information
Structure
MolImage
Molecular Formula
CH₄N₂O₂
Molecular Mass
76.05466
Exact Mass
76.02727738
Charge
0
InChI
InChI=1S/CH4N2O2/c2-1(4)3-5/h5H,(H3,2,3,4)
InChIKey
VSNHCAURESNICA-UHFFFAOYSA-N
Canonic Smiles
NC(=O)NO
Isomeric Smiles
ONC(=O)N
Calculated Properties
JChem
LogD (pH = 7.4)
-1.37
LogD (pH = 5.5)
-1.37
Log P
-1.37
Rotatable Bonds
0
H Donor
3
H Acceptors
2
Lipinski's Rule of Five
true
Acid pKa
10.14
Polar Surface Area
75.35
Polarizability
5.94
Molar Refractivity
14.91
LOG S
0.74
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
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Bioactivity
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