nedisertib (CHEBI:757098)

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CHEBI:757098 - nedisertib

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ChEBI ID	CHEBI:757098
ChEBI Name	nedisertib
Stars
Last Modified	30 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C24H21ClFN5O3
Net Charge	0
Average Mass	481.915
Monoisotopic Mass	481.13170
SMILES	COc1ccc([C@@H](O)c2cc(-c3ncnc4cc(N5CCOCC5)ccc34)c(F)cc2Cl)nn1
InChI	InChI=1S/C24H21ClFN5O3/c1-33-22-5-4-20(29-30-22)24(32)16-11-17(19(26)12-18(16)25)23-15-3-2-14(10-21(15)27-13-28-23)31-6-8-34-9-7-31/h2-5,10-13,24,32H,6-9H2,1H3/t24-/m0/s1
InChIKey	MOWXJLUYGFNTAL-DEOSSOPVSA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	nedisertib (CHEBI:757098) has role antineoplastic agent (CHEBI:35610)
	nedisertib (CHEBI:757098) is a quinazolines (CHEBI:38530)

INNs	Source
nedisertib	WHO MedNet
peposertib	WHO MedNet

Synonyms	Source
M-3814	ChEMBL
M3814	ChEMBL
MSC 2490484A	ChEMBL
MSC-2490484A	ChEMBL
MSC2490484A	ChEMBL

Citations