Molecule

ID:43928

General Information
Structure
MolImage
Molecular Formula
C₂₄H₂₄O₄
Molecular Mass
376.44496
Exact Mass
376.16745925
Charge
0
InChI
InChI=1S/C24H24O4/c1-19(25)21-8-10-22(11-9-21)26-16-5-17-27-23-12-14-24(15-13-23)28-18-20-6-3-2-4-7-20/h2-4,6-15H,5,16-18H2,1H3
InChIKey
BBGXSLZJTXHEAA-UHFFFAOYSA-N
Canonic Smiles
CC(=O)c1ccc(cc1)OCCCOc1ccc(cc1)OCc1ccccc1
Isomeric Smiles
C(=O)(c1ccc(cc1)OCCCOc1ccc(OCc2ccccc2)cc1)C
Calculated Properties
JChem
Acid pKa
16.27594
H Acceptors
4
H Donor
0
LogD (pH = 5.5)
4.6440334
LogD (pH = 7.4)
4.6440334
Log P
4.6440334
Molar Refractivity
109.4174
Polarizability
42.649933
Polar Surface Area
44.76
Rotatable Bonds
10
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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