BDBM50223879 CHEMBL280688

SMILES: CN1CCC23CCCCC2C1Cc1ccc(OC(C)(C)C)cc31

InChI Key: InChIKey=HWTLPRHSBYNYIX-UHFFFAOYSA-N

Data: 1 IC50

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 = 50223879   

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
Opioid receptor (Mus musculus (Mouse)-MOUSE)	BDBM50223879 (CHEMBL280688) Show SMILES CN1CCC23CCCCC2C1Cc1ccc(OC(C)(C)C)cc31 |TLB:0:1:9:22.12.11,THB:21:22:9:1.3.2| Show InChI InChI=1S/C21H31NO/c1-20(2,3)23-16-9-8-15-13-19-17-7-5-6-10-21(17,18(15)14-16)11-12-22(19)4/h8-9,14,17,19H,5-7,10-13H2,1-4H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration required to inhibit [3H]naltrexone binding to Opioid receptors				J Med Chem 25: 1264-6 (1982) BindingDB Entry DOI: 10.7270/Q29P33VW
					More data for this Ligand-Target Pair