P684
| Id | 684 |
| Inchikey | FWJSOTKQDQLPTA-UHFFFAOYSA-N |
| Smiles | COc1cc(NCc2cncs2)ccn1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.99168 |
| Binding_energy | -89.532631 |
| Ligand_energy | 30.1532555277996 |
| Placement | Placement_685 "DNV2_NS5A-x0615 w/ C685" |