Molecule

ID:91061

General Information
Structure
Molecular Formula
C₂₄H₁₆O₂
Molecular Mass
336.38264
Exact Mass
336.11502975
Charge
0
InChI
InChI=1S/C24H16O2/c1-15(25)26-20-10-11-22-17(12-20)8-9-19-13-23-18(14-24(19)22)7-6-16-4-2-3-5-21(16)23/h2-14H,1H3
InChIKey
YMQDQOSGAXDBMK-UHFFFAOYSA-N
Canonic Smiles
CC(=O)Oc1ccc2c(c1)ccc1c2cc2ccc3c(c2c1)cccc3
Isomeric Smiles
O(c1ccc2c3cc4ccc5c(c4cc3ccc2c1)cccc5)C(=O)C
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
5.538414
LogD (pH = 7.4)
5.538414
Log P
5.538414
Molar Refractivity
102.9912
Polarizability
45.23832
Polar Surface Area
26.3
Rotatable Bonds
2
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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