P787
| Id | 787 |
| Inchikey | DJVQSQXCKGQNJE-UHFFFAOYSA-N |
| Smiles | Cc1cnccc1NCc1c[nH]cn1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.997294 |
| Binding_energy | -27.523897 |
| Ligand_energy | 14.733374329707438 |
| Placement | Placement_788 "DNV2_NS5A-x0472 w/ C788" |