P814
| Id | 814 |
| Inchikey | GUFDDOCDYVUCQD-ZJUUUORDSA-N |
| Smiles | CC[C@@]1([C@H](N)c2cncs2)CCCO1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.9512 |
| Binding_energy | -31.597781 |
| Ligand_energy | 18.35489618434248 |
| Placement | Placement_815 "DNV2_NS5A-x0254 w/ C815" |