Molecular Details
DICL_CP_0328723
- 1-benzyl-N-(furan-2-ylmethyl)benzimidazol-2-amine
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0328723
PubChem CID
Molecular Formula
C19H17N3O Molecular Weight
303.365 g/mol
Synonyms/Alias
N/A (Not available)
InChI Key
OECUWHDVQIITIS-UHFFFAOYSA-N
InChI
InChI=1S/C19H17N3O/c1-2-7-15(8-3-1)14-22-18-11-5-4-10-17(18)21-19(22)20-13-16-9-6-12-23-16/h1-12H,13...
IUPAC Name
1-benzyl-N-(furan-2-ylmethyl)benzimidazol-2-amine
CAS Number
N/A (Not available)
Structure Information
Chemical Structure Visualization
SMILES Notation
2D Molecular Drawing
Carbon (C)
Hydrogen (H)
Oxygen (O)
Nitrogen (N)
Sulfur (S)
SDF
40 43 0 0 0 0 0 0 0 0999 V2000
1.7417 -0.9568 -0.1181 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8960 0.4894 -0.2678 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8041 1.408...
Experimental Data
Activity Data
Target Ion Channel
Short transient receptor potential channel 5
Uniprot Accession Number
Function
Inhibitor
Species
Homo sapiens (Human)
IC50
IC50: 64970 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
Fluorometric Imaging Plate Reader (FLIPR) Membrane Potential Assay (Calcium ion)
Test Species
HEK-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
23
Rotatable Bonds
5
logP
4.2897
Complexity
91.3117
TPSA (Ų)
42.99
H-Bond Donors
1
H-Bond Acceptors
4
Ring Count
4