Molecule

ID:69296

General Information
Structure
MolImage
Molecular Formula
C₇H₁₆ClN
Molecular Mass
149.66164
Exact Mass
149.0971272
Charge
0
InChI
InChI=1S/C7H15N.ClH/c1-6-3-4-8-7(2)5-6;/h6-8H,3-5H2,1-2H3;1H
InChIKey
ZNWYEICTMCDWMH-UHFFFAOYSA-N
Canonic Smiles
CC1CCNC(C1)C.Cl
Isomeric Smiles
N1C(CC(CC1)C)C.Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
-1.872345
LogD (pH = 7.4)
-1.468274
Log P
1.3610818
Molar Refractivity
35.8028
Polarizability
14.445701
Polar Surface Area
12.03
Rotatable Bonds
0
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
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Molecule Details
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References
Bioactivity
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