Molecule

ID:65189

General Information
Structure
MolImage
Molecular Formula
C₁₆H₁₄
Molecular Mass
206.28236
Exact Mass
206.10955045
Charge
0
InChI
InChI=1S/C16H14/c1-3-13-5-9-15(10-6-13)16-11-7-14(4-2)8-12-16/h3-12H,1-2H2
InChIKey
IYSVFZBXZVPIFA-UHFFFAOYSA-N
Canonic Smiles
C=Cc1ccc(cc1)c1ccc(cc1)C=C
Isomeric Smiles
c1c(ccc(c1)c1ccc(cc1)C=C)C=C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
5.0938754
LogD (pH = 7.4)
5.0938754
Log P
5.0938754
Molar Refractivity
70.5668
Polarizability
28.632772
Polar Surface Area
0.0
Rotatable Bonds
3
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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