Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM222144'   

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))	BDBM222144 (2-methyl-2-propyl-2,3-dihydroquinazolin-4(1H)-one ...) Show SMILES CCCC1(C)NC(=O)c2ccccc2N1 Show InChI InChI=1S/C12H16N2O/c1-3-8-12(2)13-10-7-5-4-6-9(10)11(15)14-12/h4-7,13H,3,8H2,1-2H3,(H,14,15)	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.11E+4	n/a	n/a	n/a	n/a	8.0	n/a
University of Sargodha					Assay Description Galantamine was used as reference drugs. The synthesized quinazolines were dissolved in 0.1 M phosphate buffer of pH 8.0. (KH2PO4/K2HPO4. The reactio...				Bioorg Chem 70: 237-244 (2017) Article DOI: 10.1016/j.bioorg.2017.01.004 BindingDB Entry DOI: 10.7270/Q2M0448Z
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