Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM241978'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM241978 (4-(5-Heptyl-1,3,4-thiadiazol-2-yl)benzene-1,3-diol...) Show SMILES CCCCCCCc1nnc(s1)-c1ccc(O)cc1O Show InChI InChI=1S/C15H20N2O2S/c1-2-3-4-5-6-7-14-16-17-15(20-14)12-9-8-11(18)10-13(12)19/h8-10,18-19H,2-7H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	8.0	2
University of Life Sciences					Assay Description Seven different concentrations of the synthesized compounds in the range 10^−3-10^−9 M were measured at 412 nm. All the assays were under...				J Enzyme Inhib Med Chem 28: 816-23 (2013) Article DOI: 10.3109/14756366.2012.688041 BindingDB Entry DOI: 10.7270/Q2WW7GJ8
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