Molecule

ID:71602

General Information
Structure
MolImage
Molecular Formula
C₂H₄N₂O₂
Molecular Mass
88.06536
Exact Mass
88.02727738
Charge
0
InChI
InChI=1S/C2H4N2O2/c5-1-3-4-2-6/h1-2H,(H,3,5)(H,4,6)
InChIKey
POVXOWVFLAAVBH-UHFFFAOYSA-N
Canonic Smiles
O=CNNC=O
Isomeric Smiles
C(=O)NNC=O
Calculated Properties
JChem
Acid pKa
10.524126
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-1.7171388
LogD (pH = 7.4)
-1.7174242
Log P
-1.7171351
Molar Refractivity
18.3508
Polarizability
7.018457
Polar Surface Area
58.2
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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