Molecule

ID:74502

General Information
Structure
MolImage
Molecular Formula
C₁₆H₃₅N
Molecular Mass
241.4558
Exact Mass
241.27695013
Charge
0
InChI
InChI=1S/C16H35N/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h17H,3-16H2,1-2H3
InChIKey
LAWOZCWGWDVVSG-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCNCCCCCCCC
Isomeric Smiles
N(CCCCCCCC)CCCCCCCC
Calculated Properties
JChem
LogD (pH = 7.4)
3.02
LogD (pH = 5.5)
2.77
Log P
6.01
Rotatable Bonds
14
H Donor
1
H Acceptors
1
Lipinski's Rule of Five
false
Acid pKa
10.75
Polar Surface Area
12.03
Polarizability
34.91
Molar Refractivity
79.25
LOG S
-5.66
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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