Molecule

ID:89692

General Information
Structure
Molecular Formula
C₁₆H₃₅N
Molecular Mass
241.4558
Exact Mass
241.27695013
Charge
0
InChI
InChI=1S/C16H35N/c1-5-9-11-15(7-3)13-17-14-16(8-4)12-10-6-2/h15-17H,5-14H2,1-4H3
InChIKey
SAIKULLUBZKPDA-UHFFFAOYSA-N
Canonic Smiles
CCCCC(CNCC(CCCC)CC)CC
Isomeric Smiles
N(CC(CC)CCCC)CC(CCCC)CC
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
2.6121244
LogD (pH = 7.4)
2.7381644
Log P
5.8522773
Molar Refractivity
78.9898
Polarizability
31.812483
Polar Surface Area
12.03
Rotatable Bonds
12
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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