P440
| Id | 440 |
| Inchikey | QFDICOWEDIEKFY-UHFFFAOYSA-N |
| Smiles | CN(Cc1cncs1)C(=O)c1c[nH]c(C(=O)O)c1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.898566 |
| Binding_energy | -171.291918 |
| Ligand_energy | 25.79910636044025 |
| Placement | Placement_440 "DNV2_NS5A-x0615 w/ C440" |