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CHEBI:758640 - bafrekalant

Default Structure
ChEBI IDCHEBI:758640
ChEBI Namebafrekalant
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC29H31ClN6O2
Net Charge0
Average Mass531.060
Monoisotopic Mass530.21970
SMILESCOc1ccc(Cl)c(C(=O)N2C3CCC2CN(Cc2c(-c4ccc(C(C)C)cc4)nc4ncccn24)C3)n1
InChIInChI=1S/C29H31ClN6O2/c1-18(2)19-5-7-20(8-6-19)26-24(35-14-4-13-31-29(35)33-26)17-34-15-21-9-10-22(16-34)36(21)28(37)27-23(30)11-12-25(32-27)38-3/h4-8,11-14,18,21-22H,9-10,15-17H2,1-3H3
InChIKeyVDKJCAWGDJJKNL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
bafrekalant (CHEBI:758640) is a imidazoles (CHEBI:24780)
INN  Source
bafrekalantWHO MedNet