BDBM50042063 CHEMBL4061477

SMILES: FC(F)(F)Oc1ccccc1C(=O)NCC1NCCc2ccccc12

InChI Key: InChIKey=SMFRUGDEMNDDLK-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 = 50042063   

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))	BDBM50042063 (CHEMBL4061477) Show SMILES FC(F)(F)Oc1ccccc1C(=O)NCC1NCCc2ccccc12 Show InChI InChI=1S/C22H28N2O2/c1-14(2)10-15-11-20(19-6-4-5-7-21(19)23-15)22(25)26-18-12-16-8-9-17(13-18)24(16)3/h4-7,11,14,16-18H,8-10,12-13H2,1-3H3	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	3.31E+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