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P174 "z0892c"





Id 174
Inchikey OSKCNZZSIHVFTH-UHFFFAOYSA-N
Smiles CCc1ccc(NC2=NCCCS2)cc1
Mol
Is_fingerprinted False
Origin EXPERIMENT
Ligand_energy 19.935046938878195
Placement
Placement_174 "Zika_NS5A-x0892 w/ C172"

Tags

Tag Type Origin
"z0892c" [Observation Code]
Observation Code Fragalysis
"1a - z0351/A/1112" [ConformerSites]
ConformerSites Fragalysis/XCA
"52a - z0892/A/1303" [ConformerSites]
ConformerSites Fragalysis/XCA
"1 - z0351/A/1112/1" [CanonSites]
CanonSites Fragalysis/XCA
"52 - z0892/A/1303/1" [CanonSites]
CanonSites Fragalysis/XCA
"F4bs - z0892/A/1303" [CrystalformSites]
CrystalformSites Fragalysis/XCA
"F4b - z0900/A/1015" [CrystalformSites]
CrystalformSites Fragalysis/XCA
"A1 - all" [Quatassemblies]
Quatassemblies Fragalysis/XCA
"F4 - P43212" [Crystalforms]
Crystalforms Fragalysis/XCA
"fragment screen" [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