Molecule

ID:128002

General Information
Structure
MolImage
Molecular Formula
C₃₂H₆₄O₂
Molecular Mass
480.84936
Exact Mass
480.49063129
Charge
0
InChI
InChI=1S/C32H64O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32(33)34/h2-31H2,1H3,(H,33,34)
InChIKey
ICAIHSUWWZJGHD-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O
Isomeric Smiles
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O
Calculated Properties
JChem
LogD (pH = 7.4)
10.95
LogD (pH = 5.5)
12.71
Log P
13.37
Rotatable Bonds
30
H Donor
1
H Acceptors
2
Lipinski's Rule of Five
false
Acid pKa
4.95
Polar Surface Area
37.30
Polarizability
68.67
Molar Refractivity
150.70
LOG S
-14.41
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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