P689
| Id | 689 |
| Inchikey | KPIOPEUTUKAZNO-JTQLQIEISA-N |
| Smiles | CC[C@H](C)n1nc(-c2ccncc2)nc1-c1ncc[nH]1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.925214 |
| Binding_energy | -49.217251 |
| Ligand_energy | 39.09589892282929 |
| Placement | Placement_690 "DNV2_NS5A-x0191 w/ C690" |