gs-9901 (CHEBI:755989)

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CHEBI:755989 - gs-9901

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ChEBI ID	CHEBI:755989
ChEBI Name	gs-9901
Stars
Last Modified	29 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C22H17ClFN9O
Net Charge	0
Average Mass	477.891
Monoisotopic Mass	477.12286
SMILES	N#Cc1c(N)nc(N)nc1N[C@H](c1nc2c(F)ccc(Cl)c2c(=O)n1-c1cccnc1)C1CC1
InChI	InChI=1S/C22H17ClFN9O/c23-13-5-6-14(24)17-15(13)21(34)33(11-2-1-7-28-9-11)20(30-17)16(10-3-4-10)29-19-12(8-25)18(26)31-22(27)32-19/h1-2,5-7,9-10,16H,3-4H2,(H5,26,27,29,31,32)/t16-/m0/s1
InChIKey	XDSXYMOZKDUASY-INIZCTEOSA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	gs-9901 (CHEBI:755989) has role antineoplastic agent (CHEBI:35610)
	gs-9901 (CHEBI:755989) is a quinazolines (CHEBI:38530)

Synonyms	Source
Gs 9901	ChEMBL
Gs-9901	ChEMBL

Citations