Brief Information of the Compound and Protein
Compound Name
 Compound Info 
CAS_73573-87-2
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 PubChem ID
CID: 3410
SID: 14875897
Canonical SMILES
COc1ccc(CC(C)NCC(O)c2ccc(O)c(NC=O)c2)cc1
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Compound Formula C19H24N2O4
Compound Structure
Protein Name
 Protein Info 
Beta-1 adrenergic receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Small molecule receptor (family A GPCR)
>
Monoamine receptor
>
Adrenergic receptor
Uniprot ID
P08588
Gene Name
ADRB1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  2
1
EC50 = 39.81 nM
   TI
   LI
   LO
   TS
2
Ki = 315 nM
   TI
   LI
   LO
   TS
CL000026 CHO-K1
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  1
1
EC50 = 86 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 > 630.96 nM
2 Ki = 319 nM