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BDBM50223439 5-{(R)-2-[(R)-2-hydroxy-2-(4-hydroxy-3-hydroxymethyl-phenyl)-ethylamino]-propyl}-1H-indole-2-carboxylic acid 4-sulfamoyl-benzylamide::CHEMBL235818

SMILES: C[C@H](Cc1ccc2[nH]c(cc2c1)C(=O)NCc1ccc(cc1)S(N)(=O)=O)NC[C@H](O)c1ccc(O)c(CO)c1

InChI Key: InChIKey=PRFZKEKERRWRMV-CRYYWNKWSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50223439   
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))
BDBM50223439
PNG
(5-{(R)-2-[(R)-2-hydroxy-2-(4-hydroxy-3-hydroxymeth...)
Show SMILES C[C@H](Cc1ccc2[nH]c(cc2c1)C(=O)NCc1ccc(cc1)S(N)(=O)=O)NC[C@H](O)c1ccc(O)c(CO)c1
Show InChI InChI=1S/C28H32N4O6S/c1-17(30-15-27(35)20-5-9-26(34)22(12-20)16-33)10-19-4-8-24-21(11-19)13-25(32-24)28(36)31-14-18-2-6-23(7-3-18)39(29,37)38/h2-9,11-13,17,27,30,32-35H,10,14-16H2,1H3,(H,31,36)(H2,29,37,38)/t17-,27+/m1/s1
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MMDB

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Article
PubMed
n/an/an/an/a 0.122n/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant adrenergic beta-2 receptor expressed in CHO cells assessed as elevation in cAMP levels


Bioorg Med Chem Lett 17: 6188-91 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.031
BindingDB Entry DOI: 10.7270/Q2222VM3
More data for this
Ligand-Target Pair