P760
Id | 760 |
Inchikey | NPOUPNCGJMKKFK-LURJTMIESA-N |
Smiles | C[C@H](NCc1nc(Br)c[nH]1)c1cncs1 |
Mol |
|
Is_fingerprinted | False |
Origin | COMPUTED |
Inspiration_distance | 1.473784 |
Binding_energy | -15.69249 |
Ligand_energy | 83.26461441293107 |
Placement | Placement_761 "DNV2_NS5A-x0615 w/ C761" |