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BDBM50214247 (S)-N-(5-(3-(bis(4-(difluoromethoxy)phenyl)methylamino)-2-hydroxypropyl)-2-hydroxyphenyl)methanesulfonamide::CHEMBL399867

SMILES: CS(=O)(=O)Nc1cc(C[C@H](O)CNC(c2ccc(OC(F)F)cc2)c2ccc(OC(F)F)cc2)ccc1O

InChI Key: InChIKey=WNASSUBAOGLYFA-SFHVURJKSA-N

Data: 1 KI

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50214247   
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-3 adrenergic receptor


(Homo sapiens (Human))		BDBM50214247
PNG
((S)-N-(5-(3-(bis(4-(difluoromethoxy)phenyl)methyla...)
Show SMILES CS(=O)(=O)Nc1cc(C[C@H](O)CNC(c2ccc(OC(F)F)cc2)c2ccc(OC(F)F)cc2)ccc1O
Show InChI InChI=1S/C25H26F4N2O6S/c1-38(34,35)31-21-13-15(2-11-22(21)33)12-18(32)14-30-23(16-3-7-19(8-4-16)36-24(26)27)17-5-9-20(10-6-17)37-25(28)29/h2-11,13,18,23-25,30-33H,12,14H2,1H3/t18-/m0/s1
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Article
PubMed
 340n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]iodocyanopindolol from cloned human adrenergic beta-3 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 4290-6 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.030
BindingDB Entry DOI: 10.7270/Q2M61JZT
More data for this
Ligand-Target Pair