Molecule

ID:80809

General Information
Structure
MolImage
Molecular Formula
C₂₀H₁₉O₂P
Molecular Mass
322.337421
Exact Mass
322.11226648
Charge
0
InChI
InChI=1S/C20H19O2P/c1-21-16-8-12-19(13-9-16)23(18-6-4-3-5-7-18)20-14-10-17(22-2)11-15-20/h3-15H,1-2H3
InChIKey
BJPHLVZNHDIUNY-UHFFFAOYSA-N
Canonic Smiles
COc1ccc(cc1)P(c1ccc(cc1)OC)c1ccccc1
Isomeric Smiles
P(c1ccc(cc1)OC)(c1ccc(cc1)OC)c1ccccc1
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
4.6012
LogD (pH = 7.4)
4.6012
Log P
4.6012
Molar Refractivity
94.5493
Polarizability
37.290123
Polar Surface Area
18.46
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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