P771
| Id | 771 |
| Inchikey | PHSUBCYVDMBACQ-UHFFFAOYSA-N |
| Smiles | O=C(NOc1ccccc1)c1csc(-c2ccccn2)n1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 1.006938 |
| Binding_energy | -73.538597 |
| Ligand_energy | 92.12947174957412 |
| Placement | Placement_772 "DNV2_NS5A-x0472 w/ C772" |