Molecule

ID:108088

General Information
Structure
MolImage
Molecular Formula
C₂₄H₄₆O₄
Molecular Mass
398.61964
Exact Mass
398.33960995
Charge
0
InChI
InChI=1S/C24H46O4/c1-3-5-7-9-11-13-15-17-19-21-23(25)27-28-24(26)22-20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H3
InChIKey
YIVJZNGAASQVEM-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCC(=O)OOC(=O)CCCCCCCCCCC
Isomeric Smiles
CCCCCCCCCCCC(=O)OOC(=O)CCCCCCCCCCC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
9.241891
LogD (pH = 7.4)
9.241891
Log P
9.241891
Molar Refractivity
115.504
Polarizability
46.461414
Polar Surface Area
52.6
Rotatable Bonds
23
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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