P461
| Id | 461 |
| Inchikey | MKHBBPCZLAEZGC-ZDUSSCGKSA-N |
| Smiles | O=C(C=Cc1cscn1)OCCCC[C@H]1CCCO1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.986395 |
| Binding_energy | -48.593273 |
| Ligand_energy | 35.61455609428191 |
| Placement | Placement_461 "DNV2_NS5A-x0191 w/ C461" |