BDBM50308338 10-Hydroxy-infractopicrin::CHEMBL589071

SMILES: Oc1ccc2c(c1)c1cc[n+]3CCCc4cc(=O)n2c1c34

InChI Key: InChIKey=TZDVCUDVOZPAPT-UHFFFAOYSA-O

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 = 50308338   

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 (Bos taurus (bovine))	BDBM50308338 (10-Hydroxy-infractopicrin | CHEMBL589071) Show SMILES Oc1ccc2c(c1)c1cc[n+]3CCCc4cc(=O)n2c1c34 Show InChI InChI=1S/C17H12N2O2/c20-11-3-4-14-13(9-11)12-5-7-18-6-1-2-10-8-15(21)19(14)17(12)16(10)18/h3-5,7-9H,1-2,6H2/p+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.27E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Plant Biochemistry Curated by ChEMBL					Assay Description Inhibition of bovine AChE by Elman's method				Bioorg Med Chem 18: 2173-7 (2010) Article DOI: 10.1016/j.bmc.2010.01.074 BindingDB Entry DOI: 10.7270/Q2R78G5X
					More data for this Ligand-Target Pair