BDBM50405622 CHEMBL67631

SMILES: Cc1ccc(OC[C@@H](O)[C@@H]2CCCCN2)cc1

InChI Key: InChIKey=XEHSYSYFUMPVBX-UONOGXRCSA-N

Data: 2 Kd

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 2 hits for monomerid = 50405622   

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
Beta-2 adrenergic receptor (GUINEA PIG)	BDBM50405622 (CHEMBL67631) Show SMILES Cc1ccc(OC[C@@H](O)[C@@H]2CCCCN2)cc1 Show InChI InChI=1S/C14H21NO2/c1-11-5-7-12(8-6-11)17-10-14(16)13-4-2-3-9-15-13/h5-8,13-16H,2-4,9-10H2,1H3/t13-,14+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	47.9	n/a	n/a	n/a	n/a	n/a
Universidad de Barcelona Curated by ChEMBL					Assay Description Antagonism of isoprenaline-induced relaxation of guinea pig tracheal chains, contracted with carbachol				J Med Chem 31: 2122-6 (1988) BindingDB Entry DOI: 10.7270/Q2J67J4Q
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (GUINEA PIG)	BDBM50405622 (CHEMBL67631) Show SMILES Cc1ccc(OC[C@@H](O)[C@@H]2CCCCN2)cc1 Show InChI InChI=1S/C14H21NO2/c1-11-5-7-12(8-6-11)17-10-14(16)13-4-2-3-9-15-13/h5-8,13-16H,2-4,9-10H2,1H3/t13-,14+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	58	n/a	n/a	n/a	n/a	n/a
Universidad de Barcelona Curated by ChEMBL					Assay Description Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium				J Med Chem 31: 2122-6 (1988) BindingDB Entry DOI: 10.7270/Q2J67J4Q
					More data for this Ligand-Target Pair