Molecule

ID:112153

General Information
Structure
MolImage
Molecular Formula
C₃₁H₆₄O₃
Molecular Mass
484.83806
Exact Mass
484.48554591
Charge
0
InChI
InChI=1S/C31H64O3/c1-4-7-10-13-16-19-22-25-28-32-31(33-29-26-23-20-17-14-11-8-5-2)34-30-27-24-21-18-15-12-9-6-3/h31H,4-30H2,1-3H3
InChIKey
CNSJQNJSRMMTIC-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCOC(OCCCCCCCCCC)OCCCCCCCCCC
Isomeric Smiles
CCCCCCCCCCOC(OCCCCCCCCCC)OCCCCCCCCCC
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
12.717375
LogD (pH = 7.4)
12.717375
Log P
12.717375
Molar Refractivity
149.7772
Polarizability
59.9452
Polar Surface Area
27.69
Rotatable Bonds
30
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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