Molecule

ID:47952

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₄Cl₂N₂
Molecular Mass
243.21696
Exact Mass
242.13165414
Charge
0
InChI
InChI=1S/C10H22N2.2ClH/c1-3-12(4-2)9-10-5-7-11-8-6-10;;/h10-11H,3-9H2,1-2H3;2*1H
InChIKey
RSKVSNAYZCFQBS-UHFFFAOYSA-N
Canonic Smiles
CCN(CC1CCNCC1)CC.Cl.Cl
Isomeric Smiles
N1CCC(CN(CC)CC)CC1.Cl.Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-5.7115097
LogD (pH = 7.4)
-4.7338367
Log P
1.0081443
Molar Refractivity
54.4597
Polarizability
21.50448
Polar Surface Area
15.27
Rotatable Bonds
4
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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