Molecule

ID:131478

General Information
Structure
MolImage
Molecular Formula
C₃₆H₇₂O₂
Molecular Mass
536.95568
Exact Mass
536.55323154
Charge
0
InChI
InChI=1S/C36H72O2/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-14-12-10-8-6-4-2/h3-35H2,1-2H3
InChIKey
ZZEXXQGRXIUMCA-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCC
Isomeric Smiles
CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
14.839475
LogD (pH = 7.4)
14.839475
Log P
14.839475
Molar Refractivity
169.3423
Polarizability
67.89258
Polar Surface Area
26.3
Rotatable Bonds
34
Lipinski's Rule of Five
false
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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