Molecular Details
DICL_CP_0317982
- N,4-dipyridin-2-yl-1,3-thiazol-2-amine
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0317982
PubChem CID
Molecular Formula
C13H10N4S Molecular Weight
254.318 g/mol
Synonyms/Alias
[3374-88-7; ICA; Pyridin-2-yl-(4-pyridin-2-yl-thiazol-2-yl)-amine; TCMDC-124275; N;4-dipyridin-2-yl-1;3-thiazol-2-amine; GNF-PF-4773; CHEMBL489770; GW354586X; CBMicro_026353; Cambridge id 5625000; SCH...
InChI Key
RYCUBTFYRLAMFA-UHFFFAOYSA-N
InChI
InChI=1S/C13H10N4S/c1-3-7-14-10(5-1)11-9-18-13(16-11)17-12-6-2-4-8-15-12/h1-9H,(H,15,16,17)
IUPAC Name
N,4-dipyridin-2-yl-1,3-thiazol-2-amine
CAS Number
696628-24-7
Structure Information
Chemical Structure Visualization
SMILES Notation
2D Molecular Drawing
Carbon (C)
Hydrogen (H)
Oxygen (O)
Nitrogen (N)
Sulfur (S)
SDF
28 30 0 0 0 0 0 0 0 0999 V2000
5.3542 -0.4740 -0.0056 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6561 0.8662 -0.2458 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6173 1.793...
Experimental Data
Activity Data
Target Ion Channel
Small conductance calcium activated potassium channel protein 3
Uniprot Accession Number
Function
Blocker
Species
Rattus norvegicus (Rat)
IC50
IC50: 25 nM
EC50
N/A (Not available)
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
Binding assay ([125I]-apamin)
Test Species
Not specified
Binding Information
Binding Site
Not specified
Binding Site Residue
Not specified
Disease Information
Related Disease
Not specified
References
Computed Properties
Heavy Atom Count
18
Rotatable Bonds
3
logP
3.3437
Complexity
72.8647
TPSA (Ų)
50.7
H-Bond Donors
1
H-Bond Acceptors
5
Ring Count
3