Molecule

ID:112388

General Information
Structure
MolImage
Molecular Formula
C₁₇H₃₈N₂
Molecular Mass
270.49702
Exact Mass
270.30349923
Charge
0
InChI
InChI=1S/C17H38N2/c1-5-9-13-18(14-10-6-2)17-19(15-11-7-3)16-12-8-4/h5-17H2,1-4H3
InChIKey
XHQHCZJKIMGMBY-UHFFFAOYSA-N
Canonic Smiles
CCCCN(CN(CCCC)CCCC)CCCC
Isomeric Smiles
CCCCN(CCCC)CN(CCCC)CCCC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
2.1736557
LogD (pH = 7.4)
4.2614503
Log P
5.614511
Molar Refractivity
88.3111
Polarizability
35.175064
Polar Surface Area
6.48
Rotatable Bonds
14
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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