Molecule

ID:107726

General Information
Structure
Molecular Formula
C₁₈H₁₄
Molecular Mass
230.30376
Exact Mass
230.10955045
Charge
0
InChI
InChI=1S/C18H14/c1-3-7-15(8-4-1)17-11-13-18(14-12-17)16-9-5-2-6-10-16/h1-14H
InChIKey
XJKSTNDFUHDPQJ-UHFFFAOYSA-N
Canonic Smiles
c1ccc(cc1)c1ccc(cc1)c1ccccc1
Isomeric Smiles
c1ccc(cc1)c1ccc(cc1)c1ccccc1
Calculated Properties
JChem
LogD (pH = 7.4)
5.27
LogD (pH = 5.5)
5.27
Log P
5.27
Rotatable Bonds
2
H Donor
0
H Acceptors
0
Lipinski's Rule of Five
false
Polar Surface Area
0.00
Polarizability
27.56
Molar Refractivity
76.33
LOG S
-6.24
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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