P424
| Id | 424 |
| Inchikey | AERBMRZOJIZISH-BXGCZWRVSA-N |
| Smiles | C[C@@H]1OCC[C@@H]1[S@@+]([O-])CCC1CNC1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.978291 |
| Binding_energy | -38.953418 |
| Ligand_energy | 26.61434316366899 |
| Placement | Placement_424 "DNV2_NS5A-x0254 w/ C424" |