Research Article
Design, Synthesis, Molecular Docking, and Antibacterial Evaluation of Some Novel Flouroquinolone Derivatives as Potent Antibacterial Agent
Table 3
Docking result of fluoroquinolones analogue.
| Sr. number | Title | Docking -score | Glide energy | Glide Emodel | XP H-bond | XP LipophilicEvdW | XP Electro |
| 1 | 8g | −8.51 | −54.3846 | −105.214 | −2.68 | −4.84 | −0.99 | 2 | 8i | −8.23 | −72.1348 | −119.918 | −1.09 | −6.14 | −1.01 | 3 | 8e | −8.22 | −70.9957 | −98.0172 | −1.95 | −4.99 | −1.27 | 4 | 8c | −7.95 | −73.5718 | −104.847 | −1.83 | −4.96 | −1.16 | 5 | 8s | −7.83 | −69.62 | −117.139 | −1.89 | −5.67 | −1.27 | 6 | 8q | −7.68 | −63.5086 | −106.854 | −2.3 | −4.98 | −1.4 | 7 | 8h | −7.56 | −74.8308 | −102.867 | −2.27 | −4.06 | −1.23 | 8 | 8n | −7.53 | −65.1719 | −95.4165 | −0.68 | −5.69 | −1.16 | 9 | 8a | −7.43 | −57.3206 | −84.8511 | −2.16 | −5.19 | −1.08 | 10 | 8b | −7.26 | −69.2937 | −97.1236 | −2.11 | −4.74 | −1.41 | 11 | 8r | −7.26 | −65.4352 | −109.856 | −0.81 | −4.92 | −1.54 | 12 | 8p | −6.84 | −62.2759 | −99.8452 | −0.68 | −3.76 | −2.4 | 13 | 8j | −6.4 | −69.2569 | −108.236 | −1.76 | −4.42 | −1.21 | 14 | 8f | −6.39 | −69.32 | −107.169 | −0.64 | −6.27 | −0.49 | 15 | 8k | −6.31 | −67.8452 | −108.441 | −0.04 | −6.28 | 0.02 | 16 | 8l | −5.79 | −68.5566 | −97.1257 | −0.80 | −5.44 | −0.35 | 17 | 8t | −5.57 | −67.2658 | −102.789 | −0.64 | −4.75 | −1.18 | 18 | 8m | −5.11 | −55.2368 | −103.655 | −0.81 | −4.15 | −1.15 | 19 | 8d | −3.86 | −62.1285 | −105.235 | −0.8 | −5.85 | −1.21 | 20 | 8o | −3.63 | −69.23 | −110.249 | −2.01 | −4.56 | −1.07 |
| Standards were taken |
| Norfloxacin | −7.29 | −54.2302 | −83.0725 | −1.68 | −4.14 | −1.04 |
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