Molecule

ID:47977

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₆Cl₂N₂
Molecular Mass
305.28634
Exact Mass
304.1473042
Charge
0
InChI
InChI=1S/C15H24N2.2ClH/c1-2-17(12-14-6-4-3-5-7-14)13-15-8-10-16-11-9-15;;/h3-7,15-16H,2,8-13H2,1H3;2*1H
InChIKey
XFYHSVKWCJQJMQ-UHFFFAOYSA-N
Canonic Smiles
CCN(Cc1ccccc1)CC1CCNCC1.Cl.Cl
Isomeric Smiles
N1CCC(CN(Cc2ccccc2)CC)CC1.Cl.Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-4.3214793
LogD (pH = 7.4)
-3.0106764
Log P
2.3758094
Molar Refractivity
74.3237
Polarizability
29.294325
Polar Surface Area
15.27
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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