Molecule

ID:24007

General Information
Structure
MolImage
Molecular Formula
C₁₁H₂₄Cl₂N₂
Molecular Mass
255.22766
Exact Mass
254.13165414
Charge
0
InChI
InChI=1S/C11H22N2.2ClH/c12-9-10-5-7-13(8-6-10)11-3-1-2-4-11;;/h10-11H,1-9,12H2;2*1H
InChIKey
JKDJKVNTUWIHAI-UHFFFAOYSA-N
Canonic Smiles
NCC1CCN(CC1)C1CCCC1.Cl.Cl
Isomeric Smiles
N1(CCC(CC1)CN)C1CCCC1.Cl.Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-5.2563815
LogD (pH = 7.4)
-3.9301846
Log P
1.2166499
Molar Refractivity
56.6011
Polarizability
22.610828
Polar Surface Area
29.26
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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