Molecule

ID:134743

General Information
Structure
MolImage
Molecular Formula
C₁₈H₃₆O₂
Molecular Mass
286.46254968
Exact Mass
286.27824007
Charge
0
InChI
InChI=1S/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20)/i17+1,18+1
InChIKey
QIQXTHQIDYTFRH-VJNPICPZSA-N
Canonic Smiles
CCCCCCCCCCCCCCCC[13CH2][13C](=O)O
Isomeric Smiles
CCCCCCCCCCCCCCCC[13CH2][13C](=O)O
Calculated Properties
JChem
Acid pKa
4.9520197
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
6.4899144
LogD (pH = 7.4)
4.7307796
Log P
7.14572
Molar Refractivity
86.2856
Polarizability
34.402832
Polar Surface Area
37.3
Rotatable Bonds
16
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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