P437
| Id | 437 |
| Inchikey | ADQQNIKDSYVSNG-UHFFFAOYSA-N |
| Smiles | CC(C)(C)n1ccnc1CNCCCNc1ccccc1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.829068 |
| Binding_energy | -32.777251 |
| Ligand_energy | 21.36564376506051 |
| Placement | Placement_437 "DNV2_NS5A-x0472 w/ C437" |