P456
| Id | 456 |
| Inchikey | RGSIWFCRLMCKRU-CQSZACIVSA-N |
| Smiles | CN(CCNC(=O)C[C@H]1CCCCO1)C(=O)c1cccnc1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.960775 |
| Binding_energy | -2.790234 |
| Ligand_energy | 120.59032999008211 |
| Placement | Placement_456 "DNV2_NS5A-x0254 w/ C455" |