Molecule

ID:2482

General Information
Structure
MolImage
Molecular Formula
C₆H₁₄
Molecular Mass
86.17536
Exact Mass
86.10955045
Charge
0
InChI
InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3
InChIKey
VLKZOEOYAKHREP-UHFFFAOYSA-N
Canonic Smiles
CCCCCC
Isomeric Smiles
CCCCCC
Calculated Properties
JChem
LogD (pH = 7.4)
3.13
LogD (pH = 5.5)
3.13
Log P
3.13
Rotatable Bonds
3
H Donor
0
H Acceptors
0
Lipinski's Rule of Five
true
Polar Surface Area
0.00
Polarizability
12.30
Molar Refractivity
29.41
LOG S
-2.95
Data Source
Loading...
Names and Identifiers
Loading...
Registration numbers
Loading...
Properties
Loading...
Related Proteins
Loading...
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
Loading...
References
Loading...
Bioactivity
Loading...