panulisib (CHEBI:758612)

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CHEBI:758612 - panulisib

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ChEBI ID	CHEBI:758612
ChEBI Name	panulisib
Stars
Last Modified	30 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C27H20F3N9
Net Charge	0
Average Mass	527.514
Monoisotopic Mass	527.17938
SMILES	Cn1/c(=N\C#N)n(-c2ccc(C(C)(C)C#N)nc2)c2c3cc(-c4cnc(N)c(C(F)(F)F)c4)ccc3ncc21
InChI	InChI=1S/C27H20F3N9/c1-26(2,13-31)22-7-5-17(11-35-22)39-23-18-8-15(16-9-19(27(28,29)30)24(33)36-10-16)4-6-20(18)34-12-21(23)38(3)25(39)37-14-32/h4-12H,1-3H3,(H2,33,36)/b37-25+
InChIKey	VJLRLTSXTLICIR-AUGOTPMTSA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	panulisib (CHEBI:758612) has role antineoplastic agent (CHEBI:35610)
	panulisib (CHEBI:758612) is a imidazoquinoline (CHEBI:38776)

INN	Source
panulisib	WHO MedNet

Synonyms	Source
P-7170	ChEMBL
P7170	ChEMBL