Brief Information of the Compound and Protein
Compound Name
 Compound Info 
4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol
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 PubChem ID
CID: 2083
SID: 14749528
Canonical SMILES
CC(C)(C)NCC(O)c1ccc(O)c(CO)c1
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Compound Formula C13H21NO3
Compound Structure
Protein Name
 Protein Info 
Beta-2 adrenergic receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Small molecule receptor (family A GPCR)
>
Monoamine receptor
>
Adrenergic receptor
Uniprot ID
P07550
Gene Name
ADRB2
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
Kd = 1400 nM
   TI
   LI
   LO
   TS
2
Ki = 1828 nM
   TI
   LI
   LO
   TS
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 0.11 nM
   TI
   LI
   LO
   TS
CL000246 NCI-H292
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 199.53 nM
   TI
   LI
   LO
   TS
CL000013 Sf9
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  2
1
IC50 = 980 nM
   TI
   LI
   LO
   TS
2
Ki = 510 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 1995.26 nM