Home Login

P201 "z0993b"





Id 201
Inchikey NDEZMUYBKJXUGJ-UHFFFAOYSA-N
Smiles NC(=O)c1ccnc(NC2CC=CC2)c1
Mol
Is_fingerprinted False
Origin EXPERIMENT
Ligand_energy 20.83017185827661
Placement
Placement_201 "Zika_NS5A-x0993 w/ C200"

Tags

Tag Type Origin
"z0993b" [Observation Code]
Observation Code Fragalysis
"3b - z0993/A/1113" [ConformerSites]
ConformerSites Fragalysis/XCA
"3 - z0411/A/1104/1" [CanonSites]
CanonSites Fragalysis/XCA
"F4g - z0411/A/1104" [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