Molecule

ID:135489

General Information
Structure
MolImage
Molecular Formula
C₆H₄N₂O₂
Molecular Mass
136.10816
Exact Mass
136.02727738
Charge
0
InChI
InChI=1S/C6H4N2O2/c9-8-6-4-2-1-3-5(6)7-10-8/h1-4H
InChIKey
OKEAMBAZBICIFP-UHFFFAOYSA-N
Canonic Smiles
[O-][n+]1onc2c1cccc2
Isomeric Smiles
c1ccc2c(c1)no[n+]2[O-]
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
0.2498
LogD (pH = 7.4)
0.2498
Log P
0.2498
Molar Refractivity
55.9373
Polarizability
13.466205
Polar Surface Area
52.97
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Bioactivity
Navigation