P731
| Id | 731 |
| Inchikey | QYNKZXZODFVRMI-WDEREUQCSA-N |
| Smiles | CC[C@H](NC(=O)Nc1ccc(OC(F)F)cn1)[C@H]1CCCO1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.990129 |
| Binding_energy | -10.073686 |
| Ligand_energy | 93.31164655274243 |
| Placement | Placement_732 "DNV2_NS5A-x0160 w/ C732" |