Research Article

Design and Synthesis of Pyrazole-3-one Derivatives as Hypoglycaemic Agents

Table 5

Results of docking studies for reported pyrazole-4-carboxylic acid molecules and their binding interactions with residues within 3 Å radius.

Reference compoundNumber of hydrogen bondsHydrogen bond distanceFunctional group of compoundsFunctional group of amino acidsResidue number

R412.280–N–OHSer289
R512.639–C=O–OHSer289
R612.659–CN–NHSer342
R712.138–O–CH3–OHTyr473
R812.824–OH–C=OLeu340
R922.606–OH–O–C=OGlu291
2.067–NH–C=OGln271
R1012.324–C=O–OHSer289