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CHEBI:759599 - ab-836

Default Structure
ChEBI IDCHEBI:759599
ChEBI Nameab-836
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC20H15F3N4O2
Net Charge0
Average Mass400.360
Monoisotopic Mass400.11471
SMILESC[C@H](c1cnc(=O)c2cc(F)c(F)cc12)N(C)C(=O)Nc1ccc(F)c(C#N)c1
InChIInChI=1S/C20H15F3N4O2/c1-10(15-9-25-19(28)14-7-18(23)17(22)6-13(14)15)27(2)20(29)26-12-3-4-16(21)11(5-12)8-24/h3-7,9-10H,1-2H3,(H,25,28)(H,26,29)/t10-/m1/s1
InChIKeyWKCMLORRPISTPL-SNVBAGLBSA-N
Roles Classification
Biological Role:
antiviral agent  A substance that destroys or inhibits replication of viruses.
ChEBI Ontology
Outgoing Relation(s)
ab-836 (CHEBI:759599) has role antiviral agent (CHEBI:22587)
ab-836 (CHEBI:759599) is a isoquinolines (CHEBI:24922)
Synonym  Source
Ab-836ChEMBL