P779
| Id | 779 |
| Inchikey | QCBHBPRJFDZETI-LBPRGKRZSA-N |
| Smiles | Cc1ccnc(NC(=O)NC[C@H](C)c2ccccn2)c1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 1.746607 |
| Binding_energy | -6.122039 |
| Ligand_energy | 89.66491125873023 |
| Placement | Placement_780 "DNV2_NS5A-x0472 w/ C780" |