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Gene Set: D1 - Approved - IBRUTINIB

Collection D1 : Approved
Chemical Name IBRUTINIB
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
ApprovedNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
440.497 g/mol 1 8 4.7364 True
Structure
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)/t18-/m1/s1
InChIKey XYFPWWZEPKGCCK-GOSISDBHSA-N
Links

Gene (4 / 8)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
PubChem IC50uM0.001BTKGI(Protien) :
PubChem PotencyuM11.220SMAD3-GI(Protien) :
PubChem PotencyuM3.981TDP1-GI(Protien) :
PubChem PotencyuM8.912TDP1-GI(Protien) :
PubChem PotencyuM0.000YES1GI(Protien) :
PubChem PotencyuM0.003YES1-GI(Protien) :
ChEMBLPotencynM11220.200SMAD3
-Target : CHEMBL1293258
ChEMBLPotencynM2.500YES1
-Target : CHEMBL2073
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