Molecule

ID:34278

General Information
Structure
MolImage
Molecular Formula
C₄H₆N₄
Molecular Mass
110.11724
Exact Mass
110.05924621
Charge
0
InChI
InChI=1S/C4H6N4/c5-8-4-6-2-1-3-7-4/h1-3H,5H2,(H,6,7,8)
InChIKey
QDGHXQFTWKRQTG-UHFFFAOYSA-N
Canonic Smiles
NNc1ncccn1
Isomeric Smiles
c1(ncccn1)NN
Calculated Properties
JChem
Acid pKa
15.493908
H Acceptors
4
H Donor
2
LogD (pH = 5.5)
-0.039755072
LogD (pH = 7.4)
0.11769946
Log P
0.12016409
Molar Refractivity
32.375
Polarizability
11.116639
Polar Surface Area
63.83
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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