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CHEBI:755695 - edicotinib

Default Structure
ChEBI IDCHEBI:755695
ChEBI Nameedicotinib
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC27H35N5O2
Net Charge0
Average Mass461.610
Monoisotopic Mass461.27908
SMILESCC1(C)CC=C(c2nc(C3CC(C)(C)OC(C)(C)C3)ccc2NC(=O)c2ncc(C#N)n2)CC1
InChIInChI=1S/C27H35N5O2/c1-25(2)11-9-17(10-12-25)22-21(32-24(33)23-29-16-19(15-28)30-23)8-7-20(31-22)18-13-26(3,4)34-27(5,6)14-18/h7-9,16,18H,10-14H2,1-6H3,(H,29,30)(H,32,33)
InChIKeyBNVPFDRNGHMRJS-UHFFFAOYSA-N
Roles Classification
Applications:
antirheumatic drug  A drug used to treat rheumatoid arthritis.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
edicotinib (CHEBI:755695) has role antineoplastic agent (CHEBI:35610)
edicotinib (CHEBI:755695) has role antirheumatic drug (CHEBI:35842)
edicotinib (CHEBI:755695) is a chloropyridine (CHEBI:39173)
INN  Source
edicotinibWHO MedNet
Synonym  Source
JNJ-40346527ChEMBL
Citations