Molecular Details
DICL_CP_0309872
- 5-chloroquinolin-8-ol
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0309872
PubChem CID
Molecular Formula
C9H6ClNO Molecular Weight
179.606 g/mol
Synonyms/Alias
[5-CHLORO-8-HYDROXYQUINOLINE; 130-16-5; 5-Chloroquinolin-8-ol; cloxyquin; Cloxiquine; 5-Chloro-8-quinolinol; 8-Quinolinol; 5-chloro-; 5-Chlorooxine; Dermofongin; Chlorisept; Dermofungin; 5-Chloro-8-ox...
InChI Key
CTQMJYWDVABFRZ-UHFFFAOYSA-N
InChI
InChI=1S/C9H6ClNO/c10-7-3-4-8(12)9-6(7)2-1-5-11-9/h1-5,12H
IUPAC Name
5-chloroquinolin-8-ol
CAS Number
130-26-7
Structure Information
Chemical Structure Visualization
SMILES Notation
2D Molecular Drawing
Carbon (C)
Hydrogen (H)
Oxygen (O)
Nitrogen (N)
Sulfur (S)
SDF
18 19 0 0 0 0 0 0 0 0999 V2000
2.6462 -0.5634 0.1239 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9118 0.6223 0.1765 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5090 0.587...
Experimental Data
Activity Data
Target Ion Channel
Potassium channel subfamily K member 18
Uniprot Accession Number
Function
Activator
Species
Homo sapiens (Human)
IC50
N/A (Not available)
EC50
EC50: 3800 nM
Ki
N/A (Not available)
Kd
N/A (Not available)
Inhibition
N/A (Not available)
Experimental Conditions
pH
Not mention
Holding Potential
Not specified
Temperature
Not mention
Test Method
Efflux Assay (thallium Ion)
Test Species
U2OS cell
Binding Information
Binding Site
Not specified
Binding Site Residue
Not specified
Disease Information
Related Disease
Not specified
References
Computed Properties
Heavy Atom Count
12
Rotatable Bonds
0
logP
2.5938
Complexity
48.4178
TPSA (Ų)
33.12
H-Bond Donors
1
H-Bond Acceptors
2
Ring Count
2