Ibrutinib(ID:10129-101) PP242
HMS LINCS ID: |
10129-101 |
Name: |
Ibrutinib |
Alternative Names: |
PCI-32765 |
LINCS ID: |
LSM-1129 |
PubChem CID: |
16126651 |
ChEBI ID: |
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ChEMBL ID: |
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Molecular Mass: |
440.20 |
InChi: |
InChI=1S/C25H24N6O2/c1-2-21(32)30-14-6-7-18(15-30)31-25-22(24(26)27-16-28-25)23(29-31)17-10-12-20(13-11-17)33-19-8-4-3-5-9-19/h2-5,8-13,16,18H,1,6-7,14-15H2,(H2,26,27,28) |
InChi Key: |
XYFPWWZEPKGCCK-UHFFFAOYSA-N |
SMILES: |
C=CC(=O)N1CCCC(C1)N2C3=C(C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)C(=NC=N3)N |
Relevant Citations: |
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Date Publicly Available: |
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Most Recent Update: |
2016-04-04 |
PMID: 1358655