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BDBM50326536 (R)-N-(2-chloro-4-hydroxybenzyl)-N-ethyl-2-(3-(2-(2-hydroxy-2-(4-hydroxy-3-(methylsulfonamido)phenyl)ethylamino)-2-methylpropyl)phenyl)acetamide::CHEMBL1242969

SMILES: CCN(Cc1ccc(O)cc1Cl)C(=O)Cc1cccc(CC(C)(C)NC[C@H](O)c2ccc(O)c(NS(C)(=O)=O)c2)c1

InChI Key: InChIKey=CLUFTXJUPWPJGK-NDEPHWFRSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50326536   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Beta-2 adrenergic receptor and beta-3 adrenergic receptor


(Homo sapiens (Human))
BDBM50326536
PNG
((R)-N-(2-chloro-4-hydroxybenzyl)-N-ethyl-2-(3-(2-(...)
Show SMILES CCN(Cc1ccc(O)cc1Cl)C(=O)Cc1cccc(CC(C)(C)NC[C@H](O)c2ccc(O)c(NS(C)(=O)=O)c2)c1 |r|
Show InChI InChI=1S/C30H38ClN3O6S/c1-5-34(19-23-9-11-24(35)16-25(23)31)29(38)14-20-7-6-8-21(13-20)17-30(2,3)32-18-28(37)22-10-12-27(36)26(15-22)33-41(4,39)40/h6-13,15-16,28,32-33,35-37H,5,14,17-19H2,1-4H3/t28-/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 0.370n/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant beta2 adrenergic receptor expressed in CHO cells assessed as elevation in cAMP level after 1 hr by flashplate m...


J Med Chem 53: 6640-52 (2010)


Article DOI: 10.1021/jm1005989
BindingDB Entry DOI: 10.7270/Q2X0678R
More data for this
Ligand-Target Pair