Molecule

ID:109225

General Information
Structure
MolImage
Molecular Formula
C₃₆H₇₄O
Molecular Mass
522.97216
Exact Mass
522.57396699
Charge
0
InChI
InChI=1S/C36H74O/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-36H2,1-2H3
InChIKey
HBXWUCXDUUJDRB-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCCCCOCCCCCCCCCCCCCCCCCC
Isomeric Smiles
CCCCCCCCCCCCCCCCCCOCCCCCCCCCCCCCCCCCC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
15.22027
LogD (pH = 7.4)
15.22027
Log P
15.22027
Molar Refractivity
169.58769
Polarizability
67.87426
Polar Surface Area
9.23
Rotatable Bonds
34
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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