Molecule

ID:136011

General Information
Structure
MolImage
Molecular Formula
C₃H₄N₂
Molecular Mass
71.05673263
Exact Mass
71.03487276
Charge
0
InChI
InChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5)/i3+1,4+1,5+1
InChIKey
RAXXELZNTBOGNW-FRSWOAELSA-N
Canonic Smiles
[13cH]1[15n]cc[15nH]1
Isomeric Smiles
c1c[15n][13cH][15nH]1
Calculated Properties
JChem
Acid pKa
13.396939
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-0.69591075
LogD (pH = 7.4)
-0.24231982
Log P
-0.14522421
Molar Refractivity
19.0128
Polarizability
7.142212
Polar Surface Area
28.68
Rotatable Bonds
0
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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