P742
| Id | 742 |
| Inchikey | JUSGTJATUSPCAX-LBPRGKRZSA-N |
| Smiles | O=S(=O)(NC[C@@H]1CCCO1)c1cnn(C2CCCC2)c1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.877785 |
| Binding_energy | -41.574015 |
| Ligand_energy | 30.81283446823624 |
| Placement | Placement_743 "DNV2_NS5A-x0160 w/ C743" |