Molecule

ID:134571

General Information
Structure
MolImage
Molecular Formula
C₁₂H₂₇N
Molecular Mass
186.3428889
Exact Mass
186.21138476
Charge
0
InChI
InChI=1S/C12H27N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-13H2,1H3/i13+1
InChIKey
JRBPAEWTRLWTQC-KCKQSJSWSA-N
Canonic Smiles
CCCCCCCCCCCC[15NH2]
Isomeric Smiles
CCCCCCCCCCCC[15NH2]
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
1.2310013
LogD (pH = 7.4)
1.6507778
Log P
4.2549896
Molar Refractivity
60.6004
Polarizability
24.42432
Polar Surface Area
26.02
Rotatable Bonds
10
Lipinski's Rule of Five
true
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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