Design and synthesis of pyrrolo[2,3-d]pyrimidine linked hybrids as α-amylase inhibitors: molecular docking, MD simulation, ADMET and antidiabetic screening
Ajayrajsinh R. Zala, Ramgopal Tiwari, Hem N. Naik, Iqrar Ahmad, Harun Patel, Smita Jauhari, Premlata Kumari
Topics & Concepts
AcarbosePyrimidineDocking (animal)In silicoChemistryActive siteEnzymeIn vitroAmylaseStereochemistryIC50Molecular modelCombinatorial chemistryBiochemistryMedicineNursingGeneBiochemical and Molecular ResearchNatural Antidiabetic Agents StudiesEnzyme Production and Characterization