Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002203
Inhibitor ClassPyrazolo-pyrimidine
Molecule Name in Refrence ArticlePP496
IUPAC Name(2R)-3-[4-amino-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-2-methylpropan-1-ol
FormulaC17H21N5O3
Mass343.3803
Exact Mass343.1644396
Composition C (59.46%), H (6.16%), N (20.4%), O (13.98%)
Atom Count46
PI11.01
Smilesn1cnc2c(c1N)c(nn2C[C@@H](C)CO)c1cc(c(cc1)OC)OC
InChI1S/C17H21N5O3/c1-10(8-23)7-22-17-14(16(18)19-9-20-17)15(21-22)11-4-5-12(24-2)13(6-11)25-3/h4-6,9-10,
23H,7-8H2,1-3H3,(H2,18,19,20)/t10-/m1/s1
InChIKeyORVLOIUKTHUQPU-SNVBAGLBSA-N
2D Structure
Structure Backbone
View Structure in JmolClick to view 3 d structure                            Download Mol File
Drug Like PropertyDruglikeliness
Symmetry & GeometrySymmetry And Geometrical Information
Activity & Binding Activity against isoform and covalant binding information
Topological PropertiesDescriptors
Reference18849971
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 24905334
Drug Bank Link -
ChemSpider Link 24605124
ChEMBL Link CHEMBL1242381
 
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