Molecule

ID:55230

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₅Cl₂N₃
Molecular Mass
306.2744
Exact Mass
305.14255318
Charge
0
InChI
InChI=1S/C14H23N3.2ClH/c1-16(2)14-5-3-12(4-6-14)11-17-9-7-13(15)8-10-17;;/h3-6,13H,7-11,15H2,1-2H3;2*1H
InChIKey
SLCZXCXXWSEHCM-UHFFFAOYSA-N
Canonic Smiles
NC1CCN(CC1)Cc1ccc(cc1)N(C)C.Cl.Cl
Isomeric Smiles
N1(Cc2ccc(N(C)C)cc2)CCC(CC1)N.Cl.Cl
Calculated Properties
JChem
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
-4.3028245
LogD (pH = 7.4)
-2.2127857
Log P
1.2338642
Molar Refractivity
74.4111
Polarizability
28.559599
Polar Surface Area
32.5
Rotatable Bonds
3
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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