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CHEBI:758429 - nemtabrutinib

Default Structure
ChEBI IDCHEBI:758429
ChEBI Namenemtabrutinib
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC25H23ClN4O4
Net Charge0
Average Mass478.936
Monoisotopic Mass478.14078
SMILESO=C(c1ccc(Oc2ccccc2)cc1Cl)c1cnc2ncnc(N[C@@H]3CC[C@@H](CO)OC3)c12
InChIInChI=1S/C25H23ClN4O4/c26-21-10-17(34-16-4-2-1-3-5-16)8-9-19(21)23(32)20-11-27-24-22(20)25(29-14-28-24)30-15-6-7-18(12-31)33-13-15/h1-5,8-11,14-15,18,31H,6-7,12-13H2,(H2,27,28,29,30)/t15-,18+/m1/s1
InChIKeyJSFCZQSJQXFJDS-QAPCUYQASA-N
Roles Classification
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
nemtabrutinib (CHEBI:758429) has role antineoplastic agent (CHEBI:35610)
nemtabrutinib (CHEBI:758429) is a aromatic ether (CHEBI:35618)
Synonyms  Source
ARQ-531ChEMBL
MK-1026ChEMBL
NemtabrutinibChEMBL
Citations