Molecule

ID:67235

General Information
Structure
MolImage
Molecular Formula
C₇H₁₄ClN
Molecular Mass
147.64576
Exact Mass
147.08147713
Charge
0
InChI
InChI=1S/C7H13N.ClH/c1-2-6-4-8-5-7(6)3-1;/h6-8H,1-5H2;1H
InChIKey
HVZRRRPCVOJOLJ-UHFFFAOYSA-N
Canonic Smiles
C1CC2C(C1)CNC2.Cl
Isomeric Smiles
N1CC2C(C1)CCC2.Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-2.3175461
LogD (pH = 7.4)
-2.2611938
Log P
0.9237074
Molar Refractivity
33.9764
Polarizability
13.705201
Polar Surface Area
12.03
Rotatable Bonds
0
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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