Molecule

ID:34738

General Information
Structure
MolImage
Molecular Formula
C₆H₁₀ClNO
Molecular Mass
147.6027
Exact Mass
147.04509163
Charge
0
InChI
InChI=1S/C6H10ClNO/c7-5-6(9)8-3-1-2-4-8/h1-5H2
InChIKey
AAOSLLBWWRKJIR-UHFFFAOYSA-N
Canonic Smiles
ClCC(=O)N1CCCC1
Isomeric Smiles
N1(C(=O)CCl)CCCC1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
0.36020508
LogD (pH = 7.4)
0.36020508
Log P
0.36020508
Molar Refractivity
36.5535
Polarizability
14.141739
Polar Surface Area
20.31
Rotatable Bonds
1
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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