P805
| Id | 805 |
| Inchikey | HGMRINZTTPAZBD-LBPRGKRZSA-N |
| Smiles | CC(C)C[C@H](NC(=O)c1cnc(-c2ccccn2)s1)C(F)(F)F |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.941505 |
| Binding_energy | -40.513359 |
| Ligand_energy | 58.187758680875596 |
| Placement | Placement_806 "DNV2_NS5A-x0472 w/ C806" |