Molecular Details
DICL_CP_0330012
- N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0330012
PubChem CID
Molecular Formula
C19H21N3O Molecular Weight
307.397 g/mol
Synonyms/Alias
[zolpidem; 82626-48-0; Zolpidemum; Zolpidemum [Latin]; Sanval; Zolpidem civ; N;N-Dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1;2-a]pyridin-3-yl]acetamide; UNII-7K383OQI23; DTXSID7045946; CHEBI:1012...
InChI Key
ZAFYATHCZYHLPB-UHFFFAOYSA-N
InChI
InChI=1S/C19H21N3O/c1-13-5-8-15(9-6-13)19-16(11-18(23)21(3)4)22-12-14(2)7-10-17(22)20-19/h5-10,12H,1...
IUPAC Name
N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
CAS Number
82626-48-0
Structure Information
Chemical Structure Visualization
SMILES Notation
2D Molecular Drawing
Carbon (C)
Hydrogen (H)
Oxygen (O)
Nitrogen (N)
Sulfur (S)
SDF
44 46 0 0 0 0 0 0 0 0999 V2000
6.0482 -2.3311 -0.0062 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7877 -1.5184 -0.0286 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9890 -1.421...
Experimental Data
Activity Data
Target Ion Channel
Gamma-aminobutyric acid receptor subunit alpha-3
Uniprot Accession Number
Function
Agonist
Species
Homo sapiens (Human)
IC50
N/A (Not available)
EC50
N/A (Not available)
Ki
Ki: 380 nM
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 ([3H] Ro15-1788)
Test Species
L(tk-) cell
Binding Information
Binding Site
Extracellular domain
Binding Site Residue
Benzodiazepine binding site
Disease Information
Related Disease
potent anxiolytic activity
References
Computed Properties
Heavy Atom Count
23
Rotatable Bonds
3
logP
3.2488
Complexity
92.5
TPSA (Ų)
37.61
H-Bond Donors
0
H-Bond Acceptors
3
Ring Count
3