Molecule

ID:130957

General Information
Structure
MolImage
Molecular Formula
C₂₄H₅₀O₇
Molecular Mass
450.6496
Exact Mass
450.35565394
Charge
0
InChI
InChI=1S/C24H50O7/c1-2-3-4-5-6-7-8-9-10-11-13-26-15-17-28-19-21-30-23-24-31-22-20-29-18-16-27-14-12-25/h25H,2-24H2,1H3
InChIKey
OJCFEGKCRWEVSN-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCO
Isomeric Smiles
CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCO
Calculated Properties
JChem
Acid pKa
15.121156
H Acceptors
7
H Donor
1
LogD (pH = 5.5)
4.080018
LogD (pH = 7.4)
4.080018
Log P
4.080018
Molar Refractivity
125.2039
Polarizability
49.721863
Polar Surface Area
75.61
Rotatable Bonds
28
Lipinski's Rule of Five
true
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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