Molecule

ID:136404

General Information
Structure
MolImage
Molecular Formula
C₂₆H₁₈
Molecular Mass
330.42112
Exact Mass
330.14085058
Charge
0
InChI
InChI=1S/C26H18/c1-3-11-19(12-4-1)25-21-15-7-9-17-23(21)26(20-13-5-2-6-14-20)24-18-10-8-16-22(24)25/h1-18H
InChIKey
FCNCGHJSNVOIKE-UHFFFAOYSA-N
Canonic Smiles
c1ccc2c(c1)c(c1ccccc1)c1c(c2c2ccccc2)cccc1
Isomeric Smiles
c1ccc(cc1)c1c2ccccc2c(c2c1cccc2)c1ccccc1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
7.24665
LogD (pH = 7.4)
7.24665
Log P
7.24665
Molar Refractivity
109.2308
Polarizability
48.181908
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
false
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
References
Bioactivity
Navigation