P447
| Id | 447 |
| Inchikey | CLNJFRJMGBHTHL-MRVPVSSYSA-N |
| Smiles | C[C@@H](NS(=O)(=O)c1c[nH]c(C(=O)O)c1)c1cccnc1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.862546 |
| Binding_energy | -46.001552 |
| Ligand_energy | 47.19614642891951 |
| Placement | Placement_447 "DNV2_NS5A-x0472 w/ C447" |