Molecule

ID:2293

General Information
Structure
MolImage
Molecular Formula
C₁₀H₃₀N₄++++
Molecular Mass
206.372
Exact Mass
206.24704698
Charge
4
InChI
InChI=1S/C10H26N4/c11-5-3-9-13-7-1-2-8-14-10-4-6-12/h13-14H,1-12H2/p+4
InChIKey
PFNFFQXMRSDOHW-UHFFFAOYSA-R
Canonic Smiles
[NH3+]CCC[NH2+]CCCC[NH2+]CCC[NH3+]
Isomeric Smiles
[NH3+]CCC[NH2+]CCCC[NH2+]CCC[NH3+]
Calculated Properties
JChem
LogD (pH = 7.4)
-8.77
LogD (pH = 5.5)
-12.84
Log P
-1.45
Rotatable Bonds
11
H Donor
4
H Acceptors
0
Lipinski's Rule of Five
true
Acid pKa
10.80
Polar Surface Area
88.50
Polarizability
27.95
Molar Refractivity
107.97
LOG S
0.91
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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Related Proteins
Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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