Name:Ibrutinib (PCI-32765)
Synonyms:PCI-32765,Imbruvica
CAS Number:936563-96-1
Formula:C25H24N6O2
M.w.:440.5
DMSO (mg/mL)Max Solubility:88
DMSO (mM)Max Solubility:199.77
Form:free base
SMILES:NC1=C2C(=NC=N1)[N](N=C2C3=CC=C(OC4=CC=CC=C4)C=C3)C5CCCN(C5)C(=O)C=C
ALogP:3.985
Target:BTK,Target Protein Ligand
Pathway:Angiogenesis
Information:Ibrutinib (PCI-32765,Imbruvica) is a potent and highly selective Brutons tyrosine kinase (Btk) inhibitor with IC50 of 0.5 nM in cell-free assays, modestly potent to Bmx, CSK, FGR, BRK, HCK, less potent to EGFR, Yes, ErbB2, JAK3, etc. Ibrutinib is applicable as a Btk ligand in the synthesis of a series of PROTACs including P13I.
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