Table 4. Evaluation of drug-like properties of the lead molecules by Qikprop Maestro 10.5 molecular docking suite.
| Molecule | QPlogPo/w (-2.0 to 6.5) | Q P log HERG (acceptable range: above -5.0) | QPP Caco (nm/s) <25 - poor >500 - great | Q P log BB (-3 to 1.2) | QPP MDCK (nm/s) | Q Plog Kp (-8.0 to -0.1) |
| STOCK1N-98943 | 5.344 | -6.281 | 46.395 | -2.886 | 49.729 | -3.431 |
| STOCK1N-98872 | 3.653 | -4.349 | 49.867 | -2.486 | 35.846 | -3.979 |
| STOCK1N-98956 | 5.335 | -5.366 | 141.335 | -1.887 | 108.881 | -0.2687 |
| STOCK1N-98865 | 2.971 | -2.726 | 23.795 | -1.679 | 18.639 | -4.377 |
| STOCK1N-98950 | 2.358 | -6.184 | 97.867 | -1.871 | 39.817 | -3.967 |