P735
| Id | 735 |
| Inchikey | CCDQLSZZRRFIMQ-KWQFWETISA-N |
| Smiles | C[C@@H](CC(=O)Nc1cn[nH]c1C#N)[C@@H]1CCCO1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.722332 |
| Binding_energy | -33.97969 |
| Ligand_energy | 48.90908418150994 |
| Placement | Placement_736 "DNV2_NS5A-x0254 w/ C735" |