emilumenib (CHEBI:759221)

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CHEBI:759221 - emilumenib

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ChEBI ID	CHEBI:759221
ChEBI Name	emilumenib
Stars
Last Modified	30 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C27H29F3N6O3S
Net Charge	0
Average Mass	574.629
Monoisotopic Mass	574.19739
SMILES	COc1cc(-c2ccc(CN[C@H]3C[C@@H](O)[C@@H](N(C)c4ncnc5sc(CC(F)(F)F)cc45)C3)cc2)nnc1OC
InChI	InChI=1S/C27H29F3N6O3S/c1-36(24-19-10-18(12-27(28,29)30)40-26(19)33-14-32-24)21-8-17(9-22(21)37)31-13-15-4-6-16(7-5-15)20-11-23(38-2)25(39-3)35-34-20/h4-7,10-11,14,17,21-22,31,37H,8-9,12-13H2,1-3H3/t17-,21+,22-/m1/s1
InChIKey	FFHYBSANKGPTCW-VOQZNFBZSA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	emilumenib (CHEBI:759221) has role antineoplastic agent (CHEBI:35610)
	emilumenib (CHEBI:759221) is a pyridazines (CHEBI:37921)
	emilumenib (CHEBI:759221) is a ring assembly (CHEBI:36820)

INN	Source
emilumenib	WHO MedNet

Synonym	Source
DS-1594A	ChEMBL