P353
| Id | 353 |
| Inchikey | DOOVMQBYFDXPQF-VHSXEESVSA-N |
| Smiles | C[C@H]1CCSC(N[C@H](C)c2ccncc2)=N1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.924821 |
| Binding_energy | -37.637455 |
| Ligand_energy | 24.284938197844696 |
| Placement | Placement_353 "Zika_NS5A-x0892 w/ C353" |