padnarsertib (CHEBI:756953)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:756953 - padnarsertib

Default Structure

Take structure to advanced search

ChEBI ID	CHEBI:756953
ChEBI Name	padnarsertib
Stars
Last Modified	30 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C35H29F3N4O3
Net Charge	0
Average Mass	610.636
Monoisotopic Mass	610.21918
SMILES	Nc1ccc(/C=C/C(=O)NCc2cc3cc(-c4ccc(C(=O)N5CCC(F)(F)CC5)cc4)cc(-c4ccc(F)cc4)c3o2)cn1
InChI	InChI=1S/C35H29F3N4O3/c36-28-9-7-24(8-10-28)30-19-26(23-3-5-25(6-4-23)34(44)42-15-13-35(37,38)14-16-42)17-27-18-29(45-33(27)30)21-41-32(43)12-2-22-1-11-31(39)40-20-22/h1-12,17-20H,13-16,21H2,(H2,39,40)(H,41,43)/b12-2+
InChIKey	MRFOPLWJZULAQD-SWGQDTFXSA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	padnarsertib (CHEBI:756953) has role antineoplastic agent (CHEBI:35610)
	padnarsertib (CHEBI:756953) is a benzofurans (CHEBI:35259)

INN	Source
padnarsertib	WHO MedNet

Synonyms	Source
Kpt 9274	ChEMBL
KPT-9274	ChEMBL
Pak4-in-1	ChEMBL

Citations