P474
| Id | 474 |
| Inchikey | KXKSLXFPGVFZSD-OCCSQVGLSA-N |
| Smiles | C[C@@H](O)c1ncc(CN[C@@H](CCc2ccccc2)CC(=O)O)s1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.775944 |
| Binding_energy | -69.985337 |
| Ligand_energy | 38.311548391087065 |
| Placement | Placement_474 "DNV2_NS5A-x0615 w/ C473" |