Molecular Details
DICL_CP_0341368
- (Z)-7-((1R,2S,5R)-2-hydroxy-5-((R,E)-3-hydroxyoct-1-en-1-yl)cyclopentyl)hept-5-enoic acid
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0341368
PubChem CID
N/A (Not available)
Molecular Formula
C20H34O4 Molecular Weight
338.488 g/mol
Synonyms/Alias
N/A (Not available)
InChI Key
YRFLKMLJQWGIIZ-VJUVPXECSA-N
InChI
InChI=1S/C20H34O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h4,7,12,14,16-1...
IUPAC Name
(Z)-7-((1R,2S,5R)-2-hydroxy-5-((R,E)-3-hydroxyoct-1-en-1-yl)cyclopentyl)hept-5-enoic acid
CAS Number
551-11-1
Structure Information
Chemical Structure Visualization
SMILES Notation
2D Molecular Drawing
Carbon (C)
Hydrogen (H)
Oxygen (O)
Nitrogen (N)
Sulfur (S)
SDF
58 58 0 0 0 0 0 0 0 0999 V2000
3.1772 -1.4139 0.7411 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1336 -1.5182 -0.1947 C 0 0 2 0 0 0 0 0 0 0 0 0
1.1402 -0.363...
Experimental Data
Activity Data
Target Ion Channel
Two-pore domain potassium channel subfamily K member 10
Uniprot Accession Number
Function
Activator
Species
Homo sapiens (Human)
IC50
N/A (Not available)
EC50
EC50: 294 nM
Ki
N/A (Not available)
Kd
N/A (Not available)
Inhibition
N/A (Not available)
Experimental Conditions
pH
pH 7.3
Holding Potential
Not specified
Temperature
Not mention
Test Method
Fluorometric Imaging Plate Reader (FLIPR) Membrane Potential Assay (based thallium ion flux screen)
Test Species
HEK293 cell (Homo sapiens embryonic kidney 293 cell)
Binding Information
Binding Site
Not specified
Binding Site Residue
Not specified
Disease Information
Related Disease
Not specified
References
Computed Properties
Heavy Atom Count
24
Rotatable Bonds
12
logP
4.0721
Complexity
96.7534
TPSA (Ų)
77.76
H-Bond Donors
3
H-Bond Acceptors
3
Ring Count
1