P770
| Id | 770 |
| Inchikey | SCCOTQRDELFMAJ-UHFFFAOYSA-N |
| Smiles | CCN(CCNC(=O)c1ccncc1)C(=O)c1cc[nH]c1C(C)C |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 1.921593 |
| Binding_energy | 29.934597 |
| Ligand_energy | 99.61205641779856 |
| Placement | Placement_771 "DNV2_NS5A-x0472 w/ C771" |