BDBM50131770 CHEMBL3633857

SMILES: [Br-].Brc1ccc(C[n+]2cccc(\C=C\C(=O)c3cc4ccccc4o3)c2)cc1

InChI Key: InChIKey=FDRMFZCGYDGQSN-NBYYMMLRSA-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 = 50131770   

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...)	BDBM50131770 (CHEMBL3633857) Show SMILES [Br-].Brc1ccc(C[n+]2cccc(\C=C\C(=O)c3cc4ccccc4o3)c2)cc1 Show InChI InChI=1S/C23H17BrNO2.BrH/c24-20-10-7-18(8-11-20)16-25-13-3-4-17(15-25)9-12-21(26)23-14-19-5-1-2-6-22(19)27-23;/h1-15H,16H2;1H/q+1;/p-1/b12-9+;	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	357	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