Novel flurbiprofen clubbed oxadiazole derivatives as potential urease inhibitors and their molecular docking study
Sajjad Ahmad, Momin Khan, Aftab Alam, Amar Ajmal, Abdul Wadood, Azim Khan, Abdullah F. Alasmari, Metab Alharbi, Abdulrahman Alshammari, Abdul Shakoor
Abstract
study was executed to analyse the interaction between the active site of the enzyme (urease) and the produced compounds. The docking study revealed that compounds 20, 26, 30, 24, 21, 16, 28, 31, 32, 7, 19, 13, 10, and 6 had lower docking scores than the standard compound thiourea and revealed better interactions with the urease enzyme.
Topics & Concepts
FlurbiprofenOxadiazoleUreaseChemistryDocking (animal)Combinatorial chemistryPharmacologyEnzymeBiochemistryOrganic chemistryMedicineNursingSynthesis and biological activityClick Chemistry and ApplicationsSynthesis and Characterization of Heterocyclic Compounds