Molecule

ID:88491

General Information
Structure
MolImage
Molecular Formula
C₂₅H₁₈O₃
Molecular Mass
366.40862
Exact Mass
366.12559444
Charge
0
InChI
InChI=1S/C25H18O3/c26-25(19-11-15-23(16-12-19)27-21-7-3-1-4-8-21)20-13-17-24(18-14-20)28-22-9-5-2-6-10-22/h1-18H
InChIKey
BSILAEQTGTZMIW-UHFFFAOYSA-N
Canonic Smiles
O=C(c1ccc(cc1)Oc1ccccc1)c1ccc(cc1)Oc1ccccc1
Isomeric Smiles
O=C(c1ccc(cc1)Oc1ccccc1)c1ccc(cc1)Oc1ccccc1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
6.433173
LogD (pH = 7.4)
6.433173
Log P
6.433173
Molar Refractivity
109.1151
Polarizability
42.682056
Polar Surface Area
35.53
Rotatable Bonds
6
Lipinski's Rule of Five
false
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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