P18 "d0254a"
| Id | 18 |
| Inchikey | BFRXGCPOQMOBHK-VIFPVBQESA-N |
| Smiles | Cc1ccc(NC(=O)[C@@H]2CCCO2)nc1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | EXPERIMENT |
| Ligand_energy | 15.76398203304337 |
| Placement | Placement_18 "DNV2_NS5A-x0254 w/ C18" |
| Tag | Type | Origin |
|---|---|---|
"d0254a" [Observation Code] |
Observation Code | Fragalysis |
"6a - d0254/A/1701" [ConformerSites] |
ConformerSites | Fragalysis/XCA |
"6 - d0254/A/1701/1" [CanonSites] |
CanonSites | Fragalysis/XCA |
"F1n - d0254/A/1701" [CrystalformSites] |
CrystalformSites | Fragalysis/XCA |
"A1 - all" [Quatassemblies] |
Quatassemblies | Fragalysis/XCA |
"F1 - I222" [Crystalforms] |
Crystalforms | Fragalysis/XCA |
"DENV-2" [Other] |
Other | Fragalysis Curator |
"fragment screen" [Other] |
Other | Fragalysis Curator |
"Primer grip/N-pocket (P2)" [Other] |
Other | Fragalysis Curator |
"upload_1 2024-12-06" [Other] |
Other | Fragalysis Curator |