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P26 "d0378a"





Id 26
Inchikey WWHCIFNAXSSZJE-UHFFFAOYSA-N
Smiles N#CCc1nccn1CC(F)(F)F
Mol
Is_fingerprinted False
Origin EXPERIMENT
Ligand_energy 11.490351804622087
Placement
Placement_26 "DNV2_NS5A-x0378 w/ C26"

Tags

Tag Type Origin
"d0378a" [Observation Code]
Observation Code Fragalysis
"13a - d0172/A/1701" [ConformerSites]
ConformerSites Fragalysis/XCA
"13 - d0172/A/1701/1" [CanonSites]
CanonSites Fragalysis/XCA
"F1ac - d0172/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
"RNA tunnel (P2)" [Other]
Other Fragalysis Curator
"upload_1 2024-12-06" [Other]
Other Fragalysis Curator
"upload_2 2025-03-14" [Other]
Other Fragalysis Curator