A newly synthesized small molecule: the evaluation against Alzheimer's Disease by in silico drug design and computational structure analysis methods

The submitted study reports the synthesis, crystal structure determination by the spectroscopic and non-spectroscopic methods, comparison of computational and experimental results, enclosure of the intermolecular interactions, comprehensive surface analysis by Hirshfeld method and electrostatic potential map, the examination of the electronic properties by Frontier Molecular Orbital (FMO) theory and Ultraviolet-Visible (UV-Vis) methods of an...