Molecule

ID:87485

General Information
Structure
MolImage
Molecular Formula
C₁₀H₈O₂
Molecular Mass
160.16932
Exact Mass
160.0524295
Charge
0
InChI
InChI=1S/C10H8O2/c1-7-2-3-8-4-5-10(11)12-9(8)6-7/h2-6H,1H3
InChIKey
DLHXRDUXNVEIEY-UHFFFAOYSA-N
Canonic Smiles
Cc1ccc2c(c1)oc(=O)cc2
Isomeric Smiles
o1c2cc(ccc2ccc1=O)C
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.296781
LogD (pH = 7.4)
2.296781
Log P
2.296781
Molar Refractivity
46.5898
Polarizability
17.459393
Polar Surface Area
26.3
Rotatable Bonds
0
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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