P786
| Id | 786 |
| Inchikey | FJIZSRBICNYNGK-UHFFFAOYSA-N |
| Smiles | Nc1cc(NCc2c[nH]cn2)ccn1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.992544 |
| Binding_energy | -17.539288 |
| Ligand_energy | 19.94676679943072 |
| Placement | Placement_787 "DNV2_NS5A-x0472 w/ C787" |