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 compound | Number of hydrogen bonds | Hydrogen bond distance | Functional group of compounds | Functional group of amino acids | Residue number |
| R4 | 1 | 2.280 | –N | –OH | Ser289 | R5 | 1 | 2.639 | –C=O | –OH | Ser289 | R6 | 1 | 2.659 | –CN | –NH | Ser342 | R7 | 1 | 2.138 | –O–CH3 | –OH | Tyr473 | R8 | 1 | 2.824 | –OH | –C=O | Leu340 | R9 | 2 | 2.606 | –OH | –O–C=O | Glu291 | 2.067 | –NH | –C=O | Gln271 | R10 | 1 | 2.324 | –C=O | –OH | Ser289 |
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