Brief Information of the Compound and Protein
Compound Name
 Compound Info 
CAS_155346
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 PubChem ID
CID: 155346
SID: 16799369
Canonical SMILES
CC(C)(C)NCC(O)COc1cccc2[nH]c(cc12)C#N
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Compound Formula C16H21N3O2
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)
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Monoamine receptor
>
Adrenergic receptor
Uniprot ID
P18090
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)  5
1
Ki = 0.03981 nM
   TI
   LI
   LO
   TS
2
Ki = 0.05012 nM
   TI
   LI
   LO
   TS
3
Ki = 0.1259 nM
   TI
   LI
   LO
   TS
4
Ki = 0.3162 nM
   TI
   LI
   LO
   TS
5
Ki = 316.23 nM
   TI
   LI
   LO
   TS