Molecule

ID:108240

General Information
Structure
MolImage
Molecular Formula
C₁₂H₁₀N₂O
Molecular Mass
198.2206
Exact Mass
198.07931295
Charge
0
InChI
InChI=1S/C12H10N2O/c15-13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKey
UBUCNCOMADRQHX-UHFFFAOYSA-N
Canonic Smiles
O=NN(c1ccccc1)c1ccccc1
Isomeric Smiles
O=NN(c1ccccc1)c1ccccc1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
3.3545308
LogD (pH = 7.4)
3.3545308
Log P
3.3545308
Molar Refractivity
59.6057
Polarizability
22.059004
Polar Surface Area
32.67
Rotatable Bonds
3
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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