6-[difluoro-[6-(1-methyl-4-pyrazolyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline (CHEBI:91417)

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CHEBI:91417 - 6-[difluoro-[6-(1-methyl-4-pyrazolyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline

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ChEBI ID	CHEBI:91417
ChEBI Name	6-[difluoro-[6-(1-methyl-4-pyrazolyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline
Stars
Downloads	Molfile

Formula	C19H13F2N7
Net Charge	0
Average Mass	377.358
Monoisotopic Mass	377.12005
SMILES	Cn1cc(-c2ccc3nnc(C(F)(F)c4ccc5ncccc5c4)n3n2)cn1
InChI	InChI=1S/C19H13F2N7/c1-27-11-13(10-23-27)16-6-7-17-24-25-18(28(17)26-16)19(20,21)14-4-5-15-12(9-14)3-2-8-22-15/h2-11H,1H3
InChIKey	JRWCBEOAFGHNNU-UHFFFAOYSA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	6-[difluoro-[6-(1-methyl-4-pyrazolyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline (CHEBI:91417) has role antineoplastic agent (CHEBI:35610)
	6-[difluoro-[6-(1-methyl-4-pyrazolyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline (CHEBI:91417) is a quinolines (CHEBI:26513)

Synonyms	Source
jnj-38877605	ChEMBL
Jnj-38877605	ChEMBL
JNJ-38877605-AAA	ChEMBL

Manual Xrefs	Databases
LSM-1157	LINCS

Citations