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P124 "z0471a"





Id 124
Inchikey BSUUYSUZYIKWRR-UHFFFAOYSA-N
Smiles O=C(c1cn[nH]c1)N1CCOCC1
Mol
Is_fingerprinted False
Origin EXPERIMENT
Ligand_energy 20.626756751086027
Placement
Placement_124 "Zika_NS5A-x0471 w/ C124"

Tags

Tag Type Origin
"z0471a" [Observation Code]
Observation Code Fragalysis
"28a - z0193/A/1201" [ConformerSites]
ConformerSites Fragalysis/XCA
"28 - z0193/A/1201/1" [CanonSites]
CanonSites Fragalysis/XCA
"F4au - z0193/A/1201" [CrystalformSites]
CrystalformSites Fragalysis/XCA
"A1 - all" [Quatassemblies]
Quatassemblies Fragalysis/XCA
"F4 - P43212" [Crystalforms]
Crystalforms Fragalysis/XCA
"fragment screen" [Other]
Other Fragalysis Curator
"Primer grip/N-pocket (P2)" [Other]
Other Fragalysis Curator
"ZIKV" [Other]
Other Fragalysis Curator
"upload_1 2024-12-06" [Other]
Other Fragalysis Curator
"upload_2 2025-03-14" [Other]
Other Fragalysis Curator