P500
| Id | 500 |
| Inchikey | AJQQGJNKKDEODG-UHFFFAOYSA-N |
| Smiles | c1cc(-c2cnc[nH]2)ccn1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.859558 |
| Binding_energy | -11.85689 |
| Ligand_energy | 12.950314524820271 |
| Placement | Placement_500 "DNV2_NS5A-x0472 w/ C500" |