Molecule

ID:75285

General Information
Structure
MolImage
Molecular Formula
C₁₉H₁₆N₂
Molecular Mass
272.34374
Exact Mass
272.13134852
Charge
0
InChI
InChI=1S/C19H16N2/c1-4-10-16(11-5-1)19(20-17-12-6-2-7-13-17)21-18-14-8-3-9-15-18/h1-15H,(H,20,21)
InChIKey
PMYWPCUIMGLRHO-UHFFFAOYSA-N
Canonic Smiles
c1ccc(cc1)N/C(=N/c1ccccc1)/c1ccccc1
Isomeric Smiles
N(=C(\c1ccccc1)/Nc1ccccc1)\c1ccccc1
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
3.5788193
LogD (pH = 7.4)
4.825773
Log P
5.126889
Molar Refractivity
90.3371
Polarizability
33.283657
Polar Surface Area
24.39
Rotatable Bonds
3
Lipinski's Rule of Five
false
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
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References
Bioactivity
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