BDBM50131759 CHEMBL3633868

SMILES: [Cl-].COc1cccc2cc(oc12)C(=O)\C=C\c1ccc[n+](Cc2cccc(Cl)c2Cl)c1

InChI Key: InChIKey=MPCQVMJYBZEYEN-ASTDGNLGSA-M

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 = 50131759   

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 (Tetronarce californica (Pacific electric ray) (Tor...)	BDBM50131759 (CHEMBL3633868) Show SMILES [Cl-].COc1cccc2cc(oc12)C(=O)\C=C\c1ccc[n+](Cc2cccc(Cl)c2Cl)c1 Show InChI InChI=1S/C24H18Cl2NO3.ClH/c1-29-21-9-3-6-17-13-22(30-24(17)21)20(28)11-10-16-5-4-12-27(14-16)15-18-7-2-8-19(25)23(18)26;/h2-14H,15H2,1H3;1H/q+1;/p-1/b11-10+;	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	985	n/a	n/a	n/a	n/a	n/a	n/a
Alzahra University Curated by ChEMBL					Assay Description Inhibition of Torpedo californica AChE (type VI-S) using acetylthiocholine iodide as substrate assessed as 5-thio-2-nitrobenzoate anion formation pre...				Eur J Med Chem 103: 361-9 (2015) BindingDB Entry DOI: 10.7270/Q2XK8HC1
					More data for this Ligand-Target Pair