BDBM50226763 CHEMBL1203804

SMILES: Cl.CC(C)NCC(O)COc1ccc2c(c1)oc(-c1ccccc1)c(-c1ccccc1)c2=O

InChI Key: InChIKey=BJAMIZROWHRPJP-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50226763   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Adrenergic receptor beta (Rattus norvegicus (Rat))	BDBM50226763 (CHEMBL1203804) Show SMILES Cl.CC(C)NCC(O)COc1ccc2c(c1)oc(-c1ccccc1)c(-c1ccccc1)c2=O Show InChI InChI=1S/C27H27NO4.ClH/c1-18(2)28-16-21(29)17-31-22-13-14-23-24(15-22)32-27(20-11-7-4-8-12-20)25(26(23)30)19-9-5-3-6-10-19;/h3-15,18,21,28-29H,16-17H2,1-2H3;1H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Evaluated for beta-receptor affinity determined in rat brain membrane fraction with [3H]- dihydroalprenolol				J Med Chem 30: 788-92 (1987) BindingDB Entry DOI: 10.7270/Q2FT8P8T
					More data for this Ligand-Target Pair