P685
| Id | 685 |
| Inchikey | HAAUYBAJHIVYQS-ONGXEEELSA-N |
| Smiles | CCn1cnc([C@@H](O)[C@@H]2CCCCN2)c1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.973443 |
| Binding_energy | -21.100493 |
| Ligand_energy | 9.018398541375518 |
| Placement | Placement_686 "DNV2_NS5A-x0866 w/ C686" |