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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adrenergic beta-2 receptor (beta2)' and Ligand = 'BDBM50324848'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Adrenergic beta-2 receptor (beta2)


(Homo sapiens (Human))
BDBM50324848
PNG
(4-hydroxy-7-((R)-1-hydroxy-2-((R)-1,2,3,4-tetrahyd...)
Show SMILES O[C@@H](CN[C@@H]1CCCc2ccccc12)c1ccc(O)c2[nH]c(=O)sc12
Show InChI InChI=1S/C19H20N2O3S/c22-15-9-8-13(18-17(15)21-19(24)25-18)16(23)10-20-14-7-3-5-11-4-1-2-6-12(11)14/h1-2,4,6,8-9,14,16,20,22-23H,3,5,7,10H2,(H,21,24)/t14-,16+/m1/s1
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Similars

Article
PubMed
9.40n/an/an/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from human beta2 adrenoceptor


Bioorg Med Chem Lett 20: 5302-7 (2010)

More data for this
Ligand-Target Pair