Title : Virtual screening of acetylcholinesterase inhibitors using the Lipinski's rule of five and ZINC databank.

Pub. Date : 2015

PMID : 25685814






1 Functional Relationships(s)
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1 In this study, we used the ZINC databank and the Lipinski"s rule of five to perform a virtual screening and a molecular docking (using Auto Dock Vina 1.1.1) aiming to select possible compounds that have quaternary ammonium atom able to inhibit acetylcholinesterase (AChE) activity. quaternary ammonium acetylcholinesterase (Cartwright blood group) Homo sapiens