Molecule

ID:130109

General Information
Structure
MolImage
Molecular Formula
C₂₀H₃₈O₂
Molecular Mass
310.51452
Exact Mass
310.28718046
Charge
0
InChI
InChI=1S/C20H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20(2)21/h8-9H,3-7,10-19H2,1-2H3
InChIKey
QSZKEDWVAOAFQY-UHFFFAOYSA-N
Canonic Smiles
CCCCCC/C=C/CCCCCCCCCCOC(=O)C
Isomeric Smiles
CCCCCC/C=C/CCCCCCCCCCOC(=O)C
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
7.108487
LogD (pH = 7.4)
7.108487
Log P
7.108487
Molar Refractivity
96.817
Polarizability
38.117664
Polar Surface Area
26.3
Rotatable Bonds
17
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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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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