Molecule

ID:74353

General Information
Structure
MolImage
Molecular Formula
C₂₆H₂₂O₂
Molecular Mass
366.45168
Exact Mass
366.16197994
Charge
0
InChI
InChI=1S/C26H22O2/c27-25(21-13-5-1-6-14-21,22-15-7-2-8-16-22)26(28,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,27-28H
InChIKey
MFEWNFVBWPABCX-UHFFFAOYSA-N
Canonic Smiles
OC(C(c1ccccc1)(c1ccccc1)O)(c1ccccc1)c1ccccc1
Isomeric Smiles
OC(c1ccccc1)(c1ccccc1)C(c1ccccc1)(c1ccccc1)O
Calculated Properties
JChem
Acid pKa
11.871817
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
5.3788457
LogD (pH = 7.4)
5.378831
Log P
5.3788457
Molar Refractivity
112.5256
Polarizability
44.10183
Polar Surface Area
40.46
Rotatable Bonds
5
Lipinski's Rule of Five
false
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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