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CHEBI:87284 - PF-670462 free base(2+)

ChEBI IDCHEBI:87284
ChEBI NamePF-670462 free base(2+)
Stars
DefinitionAn ammonium ion resulting from the addition of two protons to the free base of PF-670462.
Last Modified3 August 2015
SubmitterGareth Owen
DownloadsMolfile
Formula2H.C19H20FN5
Net Charge+2
Average Mass339.418
Monoisotopic Mass339.18483
SMILESNc1nccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCCC2)n1.[H+].[H+]
InChIInChI=1S/C19H20FN5/c20-14-8-6-13(7-9-14)17-18(16-10-11-22-19(21)24-16)25(12-23-17)15-4-2-1-3-5-15/h6-12,15H,1-5H2,(H2,21,22,24)/p+2
InChIKeyWUDBUIUHVNECTM-UHFFFAOYSA-P
ChEBI Ontology
Outgoing Relation(s)
PF-670462 free base(2+) (CHEBI:87284) is a ammonium ion derivative (CHEBI:35274)
PF-670462 free base(2+) (CHEBI:87284) is conjugate acid of PF-670462 free base (CHEBI:87283)
Incoming Relation(s)
PF-670462 (CHEBI:87236) has part PF-670462 free base(2+) (CHEBI:87284)
PF-670462 free base (CHEBI:87283) is conjugate base of PF-670462 free base(2+) (CHEBI:87284)
Synonym  Source
PF-670462 free base dicationChEBI