P513
| Id | 513 |
| Inchikey | NICHNLZHGMPFGC-CHWSQXEVSA-N |
| Smiles | CSC[C@H](C)CN[C@H](C)c1cn(C)nc1C1CCOCC1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.714845 |
| Binding_energy | -64.283065 |
| Ligand_energy | 19.95243510938102 |
| Placement | Placement_513 "DNV2_NS5A-x0254 w/ C512" |