Molecular Details
DICL_CP_0313943
- 2,5-diphenyl-1H-imidazole
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0313943
PubChem CID
Molecular Formula
C15H12N2 Molecular Weight
220.275 g/mol
Synonyms/Alias
[670-83-7; 2;4-Diphenylimidazole; 2;4-Diphenyl-1H-imidazole; 2;5-Diphenyl-1H-imidazole; 1H-Imidazole; 2;4-diphenyl-; 2;5-Diphenylimidazole; 2;4(5)-Diphenylimidazole; CHEMBL327027; MFCD07772899; Imidaz...
InChI Key
FHHCKYIBYRNHOZ-UHFFFAOYSA-N
InChI
InChI=1S/C15H12N2/c1-3-7-12(8-4-1)14-11-16-15(17-14)13-9-5-2-6-10-13/h1-11H,(H,16,17)
IUPAC Name
2,5-diphenyl-1H-imidazole
CAS Number
152121-47-6
Structure Information
Chemical Structure Visualization
SMILES Notation
2D Molecular Drawing
Carbon (C)
Hydrogen (H)
Oxygen (O)
Nitrogen (N)
Sulfur (S)
SDF
29 31 0 0 0 0 0 0 0 0999 V2000
5.1115 -0.1226 0.8778 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0422 -0.2348 1.7666 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7267 -0.171...
Experimental Data
Activity Data
Target Ion Channel
Sodium channel protein type 2 subunit alpha
Uniprot Accession Number
Function
Inhibitor
Species
Homo sapiens (Human)
IC50
IC50: 40600 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
−100 to 10 mV mV
Temperature
20−22 °C
Test Method
Patch-clamping
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
17
Rotatable Bonds
2
logP
3.7437
Complexity
69.4597
TPSA (Ų)
28.68
H-Bond Donors
1
H-Bond Acceptors
1
Ring Count
3