EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:756587 - bimiralisib

Default Structure
ChEBI IDCHEBI:756587
ChEBI Namebimiralisib
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC17H20F3N7O2
Net Charge0
Average Mass411.388
Monoisotopic Mass411.16306
SMILESNc1cc(C(F)(F)F)c(-c2nc(N3CCOCC3)nc(N3CCOCC3)n2)cn1
InChIInChI=1S/C17H20F3N7O2/c18-17(19,20)12-9-13(21)22-10-11(12)14-23-15(26-1-5-28-6-2-26)25-16(24-14)27-3-7-29-8-4-27/h9-10H,1-8H2,(H2,21,22)
InChIKeyADGGYDAFIHSYFI-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
bimiralisib (CHEBI:756587) has role antineoplastic agent (CHEBI:35610)
bimiralisib (CHEBI:756587) is a chloropyridine (CHEBI:39173)
INN  Source
bimiralisibWHO MedNet
Synonyms  Source
NC-B5ChEMBL
NCB5ChEMBL
PI3K-IN-2ChEMBL
PQR-309ChEMBL
PQR309ChEMBL
Citations