Molecule

ID:128972

General Information
Structure
MolImage
Molecular Formula
C₂₀H₄₂
Molecular Mass
282.54748
Exact Mass
282.32865134
Charge
0
InChI
InChI=1S/C20H42/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h17-20H,7-16H2,1-6H3
InChIKey
GGYKPYDKXLHNTI-UHFFFAOYSA-N
Canonic Smiles
CCC(CCCC(CCCC(CCCC(C)C)C)C)C
Isomeric Smiles
CCC(C)CCCC(C)CCCC(C)CCCC(C)C
Calculated Properties
JChem
LogD (pH = 7.4)
8.72
LogD (pH = 5.5)
8.72
Log P
8.72
Rotatable Bonds
13
H Donor
0
H Acceptors
0
Lipinski's Rule of Five
false
Polar Surface Area
0.00
Polarizability
39.98
Molar Refractivity
93.61
LOG S
-10.04
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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