P516
| Id | 516 |
| Inchikey | LKTUJWQNQDRKOS-RKDXNWHRSA-N |
| Smiles | Cc1nc(-c2ccccn2)sc1C(=O)N[C@H](C)[C@@H](C)C(=O)O |
| Mol |
|
| Is_fingerprinted | False |
| Origin | COMPUTED |
| Inspiration_distance | 0.983616 |
| Binding_energy | -127.857161 |
| Ligand_energy | 128.60610968714712 |
| Placement | Placement_516 "DNV2_NS5A-x0472 w/ C515" |
| User | Review |
|---|---|
| max | Interesting |