Molecular Details
DICL_CP_0339988
- N-(2-isopropyl-1H-benzo[d]imidazol-5-yl)-3-methyl-3-phenylbutanamide
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0339988
PubChem CID
N/A (Not available)
Molecular Formula
C21H25N3O Molecular Weight
335.451 g/mol
Synonyms/Alias
N/A (Not available)
InChI Key
RERHHHCSPYQCHY-UHFFFAOYSA-N
InChI
InChI=1S/C21H25N3O/c1-14(2)20-23-17-11-10-16(12-18(17)24-20)22-19(25)13-21(3,4)15-8-6-5-7-9-15/h5-12...
IUPAC Name
N-(2-isopropyl-1H-benzo[d]imidazol-5-yl)-3-methyl-3-phenylbutanamide
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
25 27 0 0 0 0 0 0 0 0999 V2000
-8.4346 1.0736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.6547 -0.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.3743 -1...
Experimental Data
Activity Data
Target Ion Channel
Voltage-gated potassium channel subfamily B member 1
Uniprot Accession Number
Function
Inhibitor
Species
Homo sapiens (Human)
IC50
IC50: 470 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
−80 mV mV
Temperature
23–25 °C
Test Method
Patch-clamping
Test Species
CHO cell (Chinese hamster ovary cell)
Binding Information
Binding Site
Extracellular domain
Binding Site Residue
RY785 and RY796
Disease Information
Related Disease
Not specified
References
Computed Properties
Heavy Atom Count
25
Rotatable Bonds
5
logP
4.9927
Complexity
102.8974
TPSA (Ų)
57.78
H-Bond Donors
2
H-Bond Acceptors
2
Ring Count
3