Table 2.
Input molecules with their detected features visualized.
| Molecule | Atoms | Features | Spatial features | Aromatic | Hydrophobic | Donors | Acceptors | Negatives | Positives | |
|---|---|---|---|---|---|---|---|---|---|---|
| 1 | Cinanserin.mol2 | 47 | 9 | 8 | 2 | 3 | 2 | 2 | 0 | 0 |
| 2 | Dipyridamole.mol2 | 72 | 20 | 14 | 2 | 4 | 6 | 6 | 0 | 2 |
| 3 | Candesartancilexetil.mol2 | 78 | 21 | 20 | 5 | 3 | 3 | 9 | 0 | 1 |
| 4 | Hydroxychloroquine.mol2 | 43 | 9 | 8 | 2 | 3 | 2 | 2 | 0 | 0 |
| 5 | Baicalein.mol2 | 30 | 11 | 8 | 3 | 0 | 3 | 5 | 0 | 0 |
| 6 | Baicalin.mol2 | 49 | 20 | 15 | 3 | 0 | 5 | 11 | 1 | 0 |
| 7 | Nelfinavir.mol2 | 71 | 20 | 18 | 3 | 8 | 3 | 6 | 0 | 0 |
| 8 | Chloroquine.mol2 | 42 | 8 | 8 | 2 | 4 | 0 | 2 | 0 | 0 |