Molecular Details
DICL_CP_0407735
- 4-(dimethylamino)-N-[3-[[2-(4-oxochromen-7-yl)oxyacetyl]amino]phenyl]benzamide
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0407735
PubChem CID
Molecular Formula
C26H23N3O5 Molecular Weight
457.486 g/mol
Synonyms/Alias
[CAY10746; CHEMBL4438748; 4-(Dimethylamino)-N-(3-(2-((4-oxo-4H-chromen-7-yl)oxy)acetamido)phenyl)benzamide; BDBM50519662; AKOS040755112; MS-28348; HY-139170; CS-0181251; G66510; 4-(dimethylamino)-N-(3...
InChI Key
WVGDUQVQWLHVEA-UHFFFAOYSA-N
InChI
InChI=1S/C26H23N3O5/c1-29(2)20-8-6-17(7-9-20)26(32)28-19-5-3-4-18(14-19)27-25(31)16-34-21-10-11-22-2...
IUPAC Name
4-(dimethylamino)-N-[3-[[2-(4-oxochromen-7-yl)oxyacetyl]amino]phenyl]benzamide
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
57 60 0 0 0 0 0 0 0 0999 V2000
-9.2909 -0.0946 1.9052 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.2403 0.9137 1.7170 N 0 0 0 0 0 0 0 0 0 0 0 0
-8.4653 2.274...
Experimental Data
Activity Data
Target Ion Channel
Transient receptor potential cation channel subfamily M member 7
Uniprot Accession Number
Function
Antagonist
Species
Homo sapiens (Human)
IC50
IC50: >10000 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
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
34
Rotatable Bonds
7
logP
4.1288
Complexity
131.7729
TPSA (Ų)
100.88
H-Bond Donors
2
H-Bond Acceptors
6
Ring Count
4