Muhammad Asam Raza, Kanwal Javaid, Umme Farwa, Anam Javaid, Muhammad Yaseen, Jan K. Maurin, Armand Budzianowski, Bushra Iqbal, Saba Ibrahim,
- A new thiourea has been prepared using one pot synthesis.
- Structure elucidation was done with XRD.
- In-Vitro enzyme inhibition and antibacterial assessments.
- DFT and Docking studies used to compare experimental and theoretical calculations.
Keywords: Density Functional Theory; Docking; Crystal Structure; Acetylcholine Esterase; Butyrylcholine Esterase