TABLE 4.
Docking results of synthesized compounds.
| Entry Name | Glide g score | Glide e model | Glide energy | XP H-Bond | Bonded Amino acid | Bond length A |
| 3 (1c) | –2.808 | –37.395 | –29.608 | –1.33 | VAL 722 | 2.18 |
| 7 (1g) | –2.715 | –38.457 | –27.458 | –0.7 | THR 724 ALA 944 | 1.91 2.08 |
| 5 (1e) | –2.174 | –28.608 | –24.17 | –0.641 | VAL 722 | 2.37 |
| 2 (1b) | –1.912 | –35.298 | –30.366 | –0.7 | LYS 947 ALA 944 | 2.51 1.80 |
| 1 (1a) | –1.636 | –31.767 | –26.491 | –0.7 | ALA 944 | 2.03 |
| 6 (1f) | –1.537 | –32.323 | –25.423 | –0.7 | THR 724 | 1.98 |
| 4 (1d) | –1.213 | –35.839 | –28.794 | –0.37 | SER 937 | 2.10 |
| 8 (1h) | –1.18 | –30.149 | –29.338 | –1.29 | THR 724 | 1.94 |
| 9 (1i) | –0.499 | –31.625 | –26.095 | –1.56 | THR 724 | 1.99 |