P475
Id | 475 |
Inchikey | CTCUCIGLJADTCY-UHFFFAOYSA-N |
Smiles | S=c1[nH]nc(-c2ncc[nH]2)s1 |
Mol |
|
Is_fingerprinted | False |
Origin | COMPUTED |
Inspiration_distance | 0.736448 |
Binding_energy | -53.778365 |
Ligand_energy | 18.214410452894285 |
Placement | Placement_475 "DNV2_NS5A-x0160 w/ C475" |