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CHEBI:748756 - rg-547

Default Structure
ChEBI IDCHEBI:748756
ChEBI Namerg-547
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC18H21F2N5O4S
Net Charge0
Average Mass441.460
Monoisotopic Mass441.12823
SMILESCOc1ccc(F)c(F)c1C(=O)c1cnc(NC2CCN(S(C)(=O)=O)CC2)nc1N
InChIInChI=1S/C18H21F2N5O4S/c1-29-13-4-3-12(19)15(20)14(13)16(26)11-9-22-18(24-17(11)21)23-10-5-7-25(8-6-10)30(2,27)28/h3-4,9-10H,5-8H2,1-2H3,(H3,21,22,23,24)
InChIKeyJRNJNYBQQYBCLE-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
rg-547 (CHEBI:748756) has role antineoplastic agent (CHEBI:35610)
rg-547 (CHEBI:748756) is a aromatic ketone (CHEBI:76224)
Synonyms  Source
R 547ChEMBL
R-547ChEMBL
RG-547ChEMBL
Ro 4584820ChEMBL
Ro-4584820ChEMBL
RO4584820ChEMBL
Citations