Molecular Details
DICL_CP_0311903
- spiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione
Basic Molecular Information
Basic Information
DICL ID
DICL_CP_0311903
PubChem CID
Molecular Formula
C11H10N2O2 Molecular Weight
202.213 g/mol
Synonyms/Alias
N/A (Not available)
InChI Key
CDALGRHRPPTQPM-UHFFFAOYSA-N
InChI
InChI=1S/C11H10N2O2/c14-9-11(13-10(15)12-9)6-5-7-3-1-2-4-8(7)11/h1-4H,5-6H2,(H2,12,13,14,15)
IUPAC Name
spiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione
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
15 17 0 0 0 0 0 0 0 0999 V2000
-2.7514 2.8466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1942 1.4539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9934 0...
Experimental Data
Activity Data
Target Ion Channel
Sodium channel protein type 1/2/3 subunit alpha
Uniprot Accession Number
Function
Inhibitor
Species
Rattus norvegicus (Rat)
IC50
IC50: 2112000 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
Not specified
Temperature
25 °C
Test Method
Binding assay ([3H] BTX-B )
Test Species
rat cerebral cortex
Binding Information
Binding Site
Not specified
Binding Site Residue
Not specified
Disease Information
Related Disease
Not specified
References
Computed Properties
Heavy Atom Count
15
Rotatable Bonds
0
logP
0.6675
Complexity
53.1154
TPSA (Ų)
58.2
H-Bond Donors
2
H-Bond Acceptors
2
Ring Count
3