BDBM50225654 CHEMBL172121

SMILES: OC(=O)CC(O)=O.CCN1CCc2n[nH]c(c2C1)-c1ccc(C)cc1

InChI Key: InChIKey=YEWGZESNUHJPCI-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 = 50225654   

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
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor (Rattus norvegicus (rat)-Rattus norvegicus (Rat))	BDBM50225654 (CHEMBL172121) Show SMILES OC(=O)CC(O)=O.CCN1CCc2n[nH]c(c2C1)-c1ccc(C)cc1 Show InChI InChI=1S/C15H19N3/c1-3-18-9-8-14-13(10-18)15(17-16-14)12-6-4-11(2)5-7-12/h4-7H,3,8-10H2,1-2H3,(H,16,17)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	350	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Ability to displace [3H]prazosin from postsynaptic alpha-1 adrenergic receptor of rat in vitro.				J Med Chem 28: 934-40 (1985) BindingDB Entry DOI: 10.7270/Q29C70NC
					More data for this Ligand-Target Pair