P66 "d1046a"
| Id | 66 |
| Inchikey | AAILEWXSEQLMNI-UHFFFAOYSA-N |
| Smiles | O=c1cccn[nH]1 |
| Mol |
|
| Is_fingerprinted | False |
| Origin | EXPERIMENT |
| Ligand_energy | 11.910343422523164 |
| Placement | Placement_66 "DNV2_NS5A-x1046 w/ C66" |
| Tag | Type | Origin |
|---|---|---|
"d1046a" [Observation Code] |
Observation Code | Fragalysis |
"25a - d1046/A/1701" [ConformerSites] |
ConformerSites | Fragalysis/XCA |
"25 - d1046/A/1701/1" [CanonSites] |
CanonSites | Fragalysis/XCA |
"F1ar - d1046/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 |
"unconfirmed" [Other] |
Other | Fragalysis Curator |
"upload_1 2024-12-06" [Other] |
Other | Fragalysis Curator |