P429
| Id | 429 |
| Inchikey | BMRWUESAXGNPLO-QGZVFWFLSA-N |
| Smiles | c1ccc([C@@H](NCCCNc2ccncc2)c2ncc[nH]2)cc1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.900928 |
| Binding_energy | -22.00663 |
| Ligand_energy | 23.63304872633961 |
| Placement | Placement_429 "DNV2_NS5A-x0191 w/ C429" |