nefextinib (CHEBI:756956)

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CHEBI:756956 - nefextinib

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ChEBI ID	CHEBI:756956
ChEBI Name	nefextinib
Stars
Last Modified	30 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C22H23FN6OS
Net Charge	0
Average Mass	438.532
Monoisotopic Mass	438.16381
SMILES	COc1cc(F)ccc1-c1c(C)sc2cnc(Nc3cnn(C4CCNCC4)c3)nc12
InChI	InChI=1S/C22H23FN6OS/c1-13-20(17-4-3-14(23)9-18(17)30-2)21-19(31-13)11-25-22(28-21)27-15-10-26-29(12-15)16-5-7-24-8-6-16/h3-4,9-12,16,24H,5-8H2,1-2H3,(H,25,27,28)
InChIKey	AVIOBQFPAGEICQ-UHFFFAOYSA-N

Roles Classification

antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology

Outgoing Relation(s)
	nefextinib (CHEBI:756956) has role antineoplastic agent (CHEBI:35610)
	nefextinib (CHEBI:756956) is a organic heterobicyclic compound (CHEBI:27171)
	nefextinib (CHEBI:756956) is a organonitrogen heterocyclic compound (CHEBI:38101)
	nefextinib (CHEBI:756956) is a organosulfur heterocyclic compound (CHEBI:38106)

INN	Source
nefextinib	WHO MedNet

Synonym	Source
MAX-40279	ChEMBL