Molecule

ID:92461

General Information
Structure
Molecular Formula
C₂₀H₁₆
Molecular Mass
256.34104
Exact Mass
256.12520051
Charge
0
InChI
InChI=1S/C20H16/c1-4-10-17(11-5-1)16-20(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16H
InChIKey
MKYQPGPNVYRMHI-UHFFFAOYSA-N
Canonic Smiles
c1ccc(cc1)/C=C(/c1ccccc1)\c1ccccc1
Isomeric Smiles
c1c(cccc1)/C=C(/c1ccccc1)\c1ccccc1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
5.7462854
LogD (pH = 7.4)
5.7462854
Log P
5.7462854
Molar Refractivity
95.0655
Polarizability
33.31346
Polar Surface Area
0.0
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
References
Bioactivity
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