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P103 "z0264b"





Id 103
Inchikey XARVCWHXIZRCGB-UHFFFAOYSA-N
Smiles NC(=O)N1CCN(c2ccc(F)cc2)CC1
Mol
Is_fingerprinted False
Origin EXPERIMENT
Ligand_energy 19.825859441111387
Placement
Placement_103 "Zika_NS5A-x0264 w/ C42"

Tags

Tag Type Origin
"z0264b" [Observation Code]
Observation Code Fragalysis
"9a - z0437/A/1201" [ConformerSites]
ConformerSites Fragalysis/XCA
"9 - z0437/A/1201/1" [CanonSites]
CanonSites Fragalysis/XCA
"F4t - z0264/A/1201" [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