Molecule

ID:48191

General Information
Structure
MolImage
Molecular Formula
C₁₂H₂₆Cl₂N₂
Molecular Mass
269.25424
Exact Mass
268.1473042
Charge
0
InChI
InChI=1S/C12H24N2.2ClH/c1-2-6-10-14(9-5-1)11-12-7-3-4-8-13-12;;/h12-13H,1-11H2;2*1H
InChIKey
FULRKQWXMAJLKM-UHFFFAOYSA-N
Canonic Smiles
C1CCC(NC1)CN1CCCCCC1.Cl.Cl
Isomeric Smiles
N1(CC2NCCCC2)CCCCCC1.Cl.Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-2.0994854
LogD (pH = 7.4)
-0.71058893
Log P
2.030834
Molar Refractivity
61.2677
Polarizability
24.457176
Polar Surface Area
15.27
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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