Molecule

ID:75159

General Information
Structure
MolImage
Molecular Formula
C₁₅H₁₄O₂
Molecular Mass
226.27046
Exact Mass
226.09937969
Charge
0
InChI
InChI=1S/C15H14O2/c1-11-7-9-12(10-8-11)13-5-3-4-6-14(13)15(16)17-2/h3-10H,1-2H3
InChIKey
IHNIAWHITVGYJJ-UHFFFAOYSA-N
Canonic Smiles
COC(=O)c1ccccc1c1ccc(cc1)C
Isomeric Smiles
O(C(=O)c1ccccc1c1ccc(cc1)C)C
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
4.1373696
LogD (pH = 7.4)
4.1373696
Log P
4.1373696
Molar Refractivity
68.2607
Polarizability
27.526035
Polar Surface Area
26.3
Rotatable Bonds
3
Lipinski's Rule of Five
true
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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