P802
| Id | 802 |
| Inchikey | RAOJLVVTLKMWSI-HNNXBMFYSA-N |
| Smiles | CCCN(CCNC(=O)c1cccnc1)CC[C@H]1CCOC1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.941997 |
| Binding_energy | -31.221101 |
| Ligand_energy | 53.20036778600939 |
| Placement | Placement_803 "DNV2_NS5A-x0191 w/ C803" |