Molecule

ID:89224

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₆Cl₂N₂
Molecular Mass
305.28634
Exact Mass
304.1473042
Charge
0
InChI
InChI=1S/C15H24N2.2ClH/c1-16-9-8-14-4-2-3-5-15(14)12-13-6-10-17-11-7-13;;/h2-5,13,16-17H,6-12H2,1H3;2*1H
InChIKey
GWRHAMGXSNFFDO-UHFFFAOYSA-N
Canonic Smiles
CNCCc1ccccc1CC1CCNCC1.Cl.Cl
Isomeric Smiles
N1CCC(CC1)Cc1ccccc1CCNC.Cl.Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
2
LogD (pH = 5.5)
-4.0861077
LogD (pH = 7.4)
-3.0156593
Log P
2.3698895
Molar Refractivity
74.083
Polarizability
29.133574
Polar Surface Area
24.06
Rotatable Bonds
5
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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