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CHEBI:747805 - Pha-680632

Default Structure
ChEBI IDCHEBI:747805
ChEBI NamePha-680632
Stars
DefinitionA potent inhibitor of Aurora A, Aurora B and Aurora C with IC50 of 27 nM, 135 nM and 120 nM, respectively. This compound has 10- to 200-fold higher IC50 for FGFR1, FLT3, LCK, PLK1, STLK2, and VEGFR2/3.
Last Modified27 May 2026
Submitterjychien
DownloadsMolfile
FormulaC28H35N7O2
Net Charge0
Average Mass501.635
Monoisotopic Mass501.28522
SMILES[H]c1c([H])c(C([H])([H])C([H])([H])[H])c(N([H])C(=O)N2C([H])([H])c3c(N([H])C(=O)c4c([H])c([H])c(N5C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C5([H])[H])c([H])c4[H])nn([H])c3C2([H])[H])c(C([H])([H])C([H])([H])[H])c1[H]
InChIInChI=1S/C28H35N7O2/c1-4-19-7-6-8-20(5-2)25(19)29-28(37)35-17-23-24(18-35)31-32-26(23)30-27(36)21-9-11-22(12-10-21)34-15-13-33(3)14-16-34/h6-12H,4-5,13-18H2,1-3H3,(H,29,37)(H2,30,31,32,36)
InChIKeyOBWNXGOQPLDDPS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Pha-680632 (CHEBI:747805) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
N-(2,6-diethylphenyl)-3-[[4-(4-methylpiperazin-1-yl)benzoyl]amino]-4,6-dihydro-1H-pyrrolo[3,4-d]pyrazole-5-carboxamide
Synonyms  Source
Pha 680632PubChem Compound
PHA-680632PubChem Compound
PHA680632PubChem Compound
Registry NumbersSources
CAS:398493-79-3CAS