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Pharmacophore features of the considered natural molecules by PharmaGist.
| S.no. | Molecule | Atoms | Features | Spatial Features | Aromatic | Hydrophobic | Donors | Acceptors | Negatives | Positives |
|---|---|---|---|---|---|---|---|---|---|---|
| 1 | Sesamin | 44 | 9 | 9 | 2 | 1 | 0 | 6 | 0 | 0 |
| 2 | Galangin | 30 | 11 | 8 | 3 | 0 | 3 | 5 | 0 | 0 |
| 3 | Ellagic acid | 28 | 14 | 10 | 2 | 0 | 4 | 8 | 0 | 0 |
| 4 | Capsaicin | 49 | 16 | 15 | 1 | 10 | 2 | 3 | 0 | 0 |
| 5 | Epicatechin | 35 | 14 | 9 | 2 | 1 | 5 | 6 | 0 | 0 |
| 6 | Carmofur* | 34 | 11 | 11 | 1 | 5 | 2 | 3 | 0 | 0 |
*Native active site inhibitor used as reference for pharmacophore modelling.
