P827
| Id | 827 |
| Inchikey | GVDCPXLSWPNOSL-GFCCVEGCSA-N |
| Smiles | C[C@H](CC(=O)Nc1c[nH]nc1-c1ccccn1)C1CCNCC1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.982923 |
| Binding_energy | -54.795659 |
| Ligand_energy | 46.55816262633452 |
| Placement | Placement_828 "DNV2_NS5A-x0851 w/ C828" |