Brief Information of the Compound and Protein
Compound Name
[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)-2,2-dimethylpropyl]-[6-[(1S,2S,4R,5R)-7-[(2S)-3-hydroxy-2-phenylpropanoyl]oxy-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-9-yl]hexyl]-dimethylazanium;dibromide
    Show/Hide
Canonical SMILES
[Br-].[Br-].CC(C)(CN1C(=O)c2cccc3cccc(C1=O)c23)C[N+](C)(C)CCCCCC[N+]1(C)[C@H]2C[C@H](C[C@@H]1[C@H]1O[C@@H]21)OC(=O)[C@H](CO)c1ccccc1
    Show/Hide
Compound Formula C42H55Br2N3O6
Compound Structure
Protein Name
Muscarinic acetylcholine receptor M2
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Small molecule receptor (family A GPCR)
>
Monoamine receptor
>
Acetylcholine receptor
Uniprot ID
P08172
Gene Name
CHRM2
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000386 Flp-In-CHO Cricetulus griseus (Chinese hamster)  5
1
Ki = 3.311 nM
   TI
   LI
   LO
   TS
2
Ki = 6.166 nM
   TI
   LI
   LO
   TS
3
Ki = 6.457 nM
   TI
   LI
   LO
   TS
4
Ki = 8.913 nM
   TI
   LI
   LO
   TS
5
Ki = 131.83 nM
   TI
   LI
   LO
   TS