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CHEBI:749068 - cpg-52852

Default Structure
ChEBI IDCHEBI:749068
ChEBI Namecpg-52852
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC17H23N5O2S
Net Charge0
Average Mass361.471
Monoisotopic Mass361.15725
SMILESCCc1nc2c(N)nc3ccccc3c2n1CCCCNS(C)(=O)=O
InChIInChI=1S/C17H23N5O2S/c1-3-14-21-15-16(12-8-4-5-9-13(12)20-17(15)18)22(14)11-7-6-10-19-25(2,23)24/h4-5,8-9,19H,3,6-7,10-11H2,1-2H3,(H2,18,20)
InChIKeyYZOQZEXYFLXNKA-UHFFFAOYSA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
cpg-52852 (CHEBI:749068) has role antineoplastic agent (CHEBI:35610)
cpg-52852 (CHEBI:749068) is a imidazoquinoline (CHEBI:38776)
Synonyms  Source
852AChEMBL
Cpg-52852ChEMBL
PF-4878691ChEMBL
Citations