Molecule

ID:108317

General Information
Structure
MolImage
Molecular Formula
C₁₂H₂₇N
Molecular Mass
185.34948
Exact Mass
185.21434987
Charge
0
InChI
InChI=1S/C12H27N/c1-4-5-6-7-8-9-10-11-12-13(2)3/h4-12H2,1-3H3
InChIKey
YWWNNLPSZSEZNZ-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCN(C)C
Isomeric Smiles
CCCCCCCCCCN(C)C
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
0.745491
LogD (pH = 7.4)
1.8218027
Log P
4.1814804
Molar Refractivity
61.4677
Polarizability
24.42432
Polar Surface Area
3.24
Rotatable Bonds
9
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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