P776
Id | 776 |
Inchikey | AUMLEUREFZMPKP-UHFFFAOYSA-N |
Smiles | Nc1cnccc1NCc1cncs1 |
Mol |
|
Is_fingerprinted | False |
Origin | COMPUTED |
Inspiration_distance | 0.871366 |
Binding_energy | -68.884706 |
Ligand_energy | 16.14235448435621 |
Placement | Placement_777 "DNV2_NS5A-x0615 w/ C776" |