Molecule

ID:80060

General Information
Structure
MolImage
Molecular Formula
C₂₄H₁₈O₂
Molecular Mass
338.39852
Exact Mass
338.13067982
Charge
0
InChI
InChI=1S/C24H18O2/c1-26-20-12-10-17(11-13-20)24(25)15-14-23-21-8-4-2-6-18(21)16-19-7-3-5-9-22(19)23/h2-16H,1H3
InChIKey
DEGUZIIIXRXDKA-UHFFFAOYSA-N
Canonic Smiles
COc1ccc(cc1)C(=O)/C=C/c1c2ccccc2cc2c1cccc2
Isomeric Smiles
O=C(c1ccc(cc1)OC)/C=C/c1c2c(cc3ccccc13)cccc2
Calculated Properties
JChem
Acid pKa
16.625105
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
5.7116075
LogD (pH = 7.4)
5.7116075
Log P
5.7116075
Molar Refractivity
106.2406
Polarizability
43.096027
Polar Surface Area
26.3
Rotatable Bonds
4
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
Click here to submit data
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
暂无数据
点击上传数据
References
Bioactivity
Navigation