P725
| Id | 725 |
| Inchikey | WJPDEPLQUUSHRX-INIZCTEOSA-N |
| Smiles | Cc1cncn1CC(=O)N[C@@H](CCNC(=O)c1cccnc1)C(C)C |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.911275 |
| Binding_energy | -1.706733 |
| Ligand_energy | 77.94392630482588 |
| Placement | Placement_726 "DNV2_NS5A-x0472 w/ C726" |