P682
Id | 682 |
Inchikey | WWDASINWQNVIKX-ZDUSSCGKSA-N |
Smiles | CCN([C@@H](C)c1cccnc1)S(=O)(=O)Cc1cccnc1 |
Mol |
|
Is_fingerprinted | False |
Origin | COMPUTED |
Inspiration_distance | 0.850219 |
Binding_energy | -43.231364 |
Ligand_energy | 34.20618990955422 |
Placement | Placement_683 "DNV2_NS5A-x0191 w/ C683" |