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CHEBI:747302 - Centrinone

Default Structure
ChEBI IDCHEBI:747302
ChEBI NameCentrinone
Stars
DefinitionCentrinone (LCR-263) is a selective and reversible inhibitor of polo-like kinase 4 (PLK4) with a Ki of 0.16 nM.
Last Modified3 February 2026
Submittercyan
DownloadsMolfile
FormulaC26H25F2N7O6S2
Net Charge0
Average Mass633.659
Monoisotopic Mass633.12758
SMILESCOc1c(Nc2cc(C)nn2)nc(Sc2ccc(S(=O)(=O)Cc3cccc([N+](=O)[O-])c3F)cc2F)nc1N1CCOCC1
InChIInChI=1S/C26H25F2N7O6S2/c1-15-12-21(33-32-15)29-24-23(40-2)25(34-8-10-41-11-9-34)31-26(30-24)42-20-7-6-17(13-18(20)27)43(38,39)14-16-4-3-5-19(22(16)28)35(36)37/h3-7,12-13H,8-11,14H2,1-2H3,(H2,29,30,31,32,33)
InChIKeyHHJSKDRCUMVWKF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Centrinone (CHEBI:747302) is a organic molecular entity (CHEBI:50860)
Synonym  Source
LCR-263PubChem Compound
Registry NumbersSources
CAS:1798871-30-3CAS