P758
| Id | 758 |
| Inchikey | SFXBVCJTOODOJM-OAHLLOKOSA-N |
| Smiles | CC(=Cc1ccccn1)C(=O)N(C)[C@]1(C(=O)O)CCOC1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 1.958785 |
| Binding_energy | 463.581154 |
| Ligand_energy | 523.9755360699739 |
| Placement | Placement_759 "DNV2_NS5A-x0254 w/ C759" |