Molecule

ID:25834

General Information
Structure
Molecular Formula
C₁₉H₁₆O₃
Molecular Mass
292.32854
Exact Mass
292.10994437
Charge
0
InChI
InChI=1S/C19H16O3/c1-21-19-9-6-14(12-20)10-17(19)13-22-18-8-7-15-4-2-3-5-16(15)11-18/h2-12H,13H2,1H3
InChIKey
QDIZDXPFRYFCMC-UHFFFAOYSA-N
Canonic Smiles
COc1ccc(cc1COc1ccc2c(c1)cccc2)C=O
Isomeric Smiles
c1(c(ccc(c1)C=O)OC)COc1cc2c(cc1)cccc2
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
4.0843554
LogD (pH = 7.4)
4.0843554
Log P
4.0843554
Molar Refractivity
86.6312
Polarizability
34.391537
Polar Surface Area
35.53
Rotatable Bonds
5
Lipinski's Rule of Five
true
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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