BDBM50003965 CHEMBL3236099

SMILES: COc1cc(NC(=O)\C=C\c2ccc(OC)c(c2)[N+]([O-])=O)cc(OC)c1OC

InChI Key: InChIKey=FEOVNLRSVROGNT-SOFGYWHQSA-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 = 50003965   

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
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50003965 (CHEMBL3236099) Show SMILES COc1cc(NC(=O)\C=C\c2ccc(OC)c(c2)[N+]([O-])=O)cc(OC)c1OC Show InChI InChI=1S/C19H20N2O7/c1-25-15-7-5-12(9-14(15)21(23)24)6-8-18(22)20-13-10-16(26-2)19(28-4)17(11-13)27-3/h5-11H,1-4H3,(H,20,22)/b8-6+	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
Quaid-I-Azam University Curated by ChEMBL					Assay Description Inhibition of electric eel acetylcholinesterase using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition after ...				Eur J Med Chem 78: 43-53 (2014) Article DOI: 10.1016/j.ejmech.2014.03.015 BindingDB Entry DOI: 10.7270/Q2KW5HKK
					More data for this Ligand-Target Pair