Molecular Details
DICL_CP_0420845
- N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;hydrobromide
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0420845
PubChem CID
Molecular Formula
C24H25BrN4S Molecular Weight
481.463 g/mol
Synonyms/Alias
[gsk205; 1263068-83-2; N-(4-(2-(benzyl(methyl)amino)ethyl)phenyl)-5-(pyridin-3-yl)thiazol-2-amine hydrobromide; GSK 205; N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1;3-thiazol-2-amine;h...
InChI Key
LQGOJHGNGSOUKL-UHFFFAOYSA-N
InChI
InChI=1S/C24H24N4S.BrH/c1-28(18-20-6-3-2-4-7-20)15-13-19-9-11-22(12-10-19)27-24-26-17-23(29-24)21-8-...
IUPAC Name
N-[4-[2-[benzyl(methyl)amino]ethyl]phenyl]-5-pyridin-3-yl-1,3-thiazol-2-amine;hydrobromide
CAS Number
1263068-83-2
Structure Information
Chemical Structure Visualization
SMILES Notation
2D Molecular Drawing
Carbon (C)
Hydrogen (H)
Oxygen (O)
Nitrogen (N)
Sulfur (S)
SDF
55 57 0 0 0 0 0 0 0 0999 V2000
-4.7909 -2.3085 0.9786 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3314 -1.0031 0.4710 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.9327 -0.755...
Experimental Data
Activity Data
Target Ion Channel
Transient receptor potential cation channel subfamily V member 4
Uniprot Accession Number
Function
Blocker
Species
Cavia porcellus (Guinea pig)
IC50
IC50: 4190 nM
EC50
N/A (Not available)
Ki
N/A (Not available)
Kd
N/A (Not available)
Inhibition
N/A (Not available)
Experimental Conditions
pH
pH 7.4
Holding Potential
Not specified
Temperature
37 °C
Test Method
Fluorometric Imaging Plate Reader (FLIPR) Membrane Potential Assay
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
30
Rotatable Bonds
8
logP
6.2011
Complexity
131.8717
TPSA (Ų)
41.05
H-Bond Donors
1
H-Bond Acceptors
5
Ring Count
4