Table 4.
Physicochemical parameters of selected 5 compounds obtained from PubChem (Kim et al. 2016)
| Ligand ID | Name of the indole derivative compound | Structure | Molecular weight (g/mol) | No. of H-bond donors | No. of H-bond acceptors | Log p |
|---|---|---|---|---|---|---|
| 0435 | 3-Chloro-N-[2-[(E)-3-(hydroxyamino)-3-oxoprop-1-enyl]phenyl]-1H-indole-2-carboxamide | ![]() |
355.8 | 4 | 3 | 3.1 |
| 0436 | 1-Ethyl-N-[2-[(E)-3-(hydroxyamino)-3-oxoprop-1-enyl]phenyl]indole-2-carboxamidepropyl]benzamide] | ![]() |
349.4 | 3 | 3 | 2.7 |
| 1812 | 5-Chloro-N-[(2R)-4-(dihydroxyamino)-4-oxo-1-phenylbutan-2-yl]-1H-indole-2-carboxamide | ![]() |
387.8 | 4 | 4 | 2.8 |
| 2584 | N-[(2S)-1-Amino-1-oxo-3-phenylpropan-2-yl]-5-chloro-1H-indole-2-carboxamide | ![]() |
341.8 | 3 | 2 | 3.2 |
| 2545 | 5-Chloro-N-[(2S,3R)-3-hydroxy-4-oxo-1-phenylpentan-2-yl]-1H-indole-2-carboxamide | ![]() |
370.8 | 3 | 3 | 3.4 |




