Molecule

ID:109552

General Information
Structure
MolImage
Molecular Formula
C₂₁H₄₄
Molecular Mass
296.57406
Exact Mass
296.34430141
Charge
0
InChI
InChI=1S/C21H44/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2/h3-21H2,1-2H3
InChIKey
FNAZRRHPUDJQCJ-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCCCCCCC
Isomeric Smiles
CCCCCCCCCCCCCCCCCCCCC
Calculated Properties
JChem
LogD (pH = 7.4)
9.80
LogD (pH = 5.5)
9.80
Log P
9.80
Rotatable Bonds
18
H Donor
0
H Acceptors
0
Lipinski's Rule of Five
false
Polar Surface Area
0.00
Polarizability
44.09
Molar Refractivity
98.42
LOG S
-10.81
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation