Molecule

ID:48043

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₂Cl₂N₂
Molecular Mass
241.20108
Exact Mass
240.11600407
Charge
0
InChI
InChI=1S/C10H20N2.2ClH/c1-9-4-2-3-7-12(9)10-5-6-11-8-10;;/h9-11H,2-8H2,1H3;2*1H
InChIKey
YZVAETMNMASWRR-UHFFFAOYSA-N
Canonic Smiles
CC1CCCCN1C1CCNC1.Cl.Cl
Isomeric Smiles
N1(C2CCNC2)C(C)CCCC1.Cl.Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-2.8447542
LogD (pH = 7.4)
-2.0039902
Log P
1.040909
Molar Refractivity
51.8399
Polarizability
20.7646
Polar Surface Area
15.27
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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