Molecule

ID:126396

General Information
Structure
MolImage
Molecular Formula
CH₆N₂O₃
Molecular Mass
94.06994
Exact Mass
94.03784206
Charge
0
InChI
InChI=1S/CH4N2O.H2O2/c2-1(3)4;1-2/h(H4,2,3,4);1-2H
InChIKey
AQLJVWUFPCUVLO-UHFFFAOYSA-N
Canonic Smiles
NC(=O)N.OO
Isomeric Smiles
O=C(N)N.OO
Calculated Properties
JChem
LogD (pH = 7.4)
-1.36
LogD (pH = 5.5)
-1.36
Log P
-1.36
Rotatable Bonds
0
H Donor
2
H Acceptors
1
Lipinski's Rule of Five
true
Acid pKa
15.73
Polar Surface Area
69.11
Polarizability
5.10
Molar Refractivity
13.14
LOG S
0.55
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
No Data Available
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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