BDBM50015440 CHEMBL4102638

SMILES: FC(F)(F)Oc1cc(Br)ccc1S(=O)(=O)N1CCc2ccccc2C1CNC(=O)C1CCCCC1

InChI Key: InChIKey=FISOFZOSQICWQY-UHFFFAOYSA-N

Data: 1 EC50

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 = 50015440   

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
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50015440 (CHEMBL4102638) Show SMILES FC(F)(F)Oc1cc(Br)ccc1S(=O)(=O)N1CCc2ccccc2C1CNC(=O)C1CCCCC1 Show InChI InChI=1S/C17H19N3O4S/c1-5-10(2)24-16(21)14-11(3)18-17(25-4)19-15(14)12-7-6-8-13(9-12)20(22)23/h6-10H,5H2,1-4H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.12E+3	n/a	n/a	n/a	n/a
National Health Research Institutes Curated by ChEMBL					Assay Description Agonist activity at human MOR expressed in CHO-K1 cells co-expressing Galpha 15 assessed as increase in intracellular calcium release incubated for 1...				Eur J Med Chem 126: 202-217 (2017) BindingDB Entry DOI: 10.7270/Q2RB76TS
					More data for this Ligand-Target Pair