Molecule

ID:77998

General Information
Structure
MolImage
Molecular Formula
C₂H₄N₂O₂
Molecular Mass
88.06536
Exact Mass
88.02727738
Charge
0
InChI
InChI=1S/C2H4N2O2/c3-1(5)2(4)6/h(H2,3,5)(H2,4,6)
InChIKey
YIKSCQDJHCMVMK-UHFFFAOYSA-N
Canonic Smiles
NC(=O)C(=O)N
Isomeric Smiles
NC(=O)C(=O)N
Calculated Properties
JChem
LogD (pH = 7.4)
-1.88
LogD (pH = 5.5)
-1.88
Log P
-1.88
Rotatable Bonds
1
H Donor
2
H Acceptors
2
Lipinski's Rule of Five
true
Acid pKa
13.41
Polar Surface Area
86.18
Polarizability
7.07
Molar Refractivity
18.08
LOG S
0.19
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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