P670
Id | 670 |
Inchikey | MSOMUWZBSNBLTC-UHFFFAOYSA-N |
Smiles | O=C(Cc1ncc[nH]1)Nc1cccc(C2CC2)n1 |
Mol |
|
Is_fingerprinted | False |
Origin | COMPUTED |
Inspiration_distance | 0.989503 |
Binding_energy | -30.176916 |
Ligand_energy | 50.278050859288385 |
Placement | Placement_671 "DNV2_NS5A-x0615 w/ C671" |