Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002160
Inhibitor ClassPyrazolo-pyrimidine
Molecule Name in Refrence ArticlePP341
IUPAC Name3-(4-ethoxy-3-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
FormulaC14H15N5O2
Mass285.3012
Exact Mass285.1225747
Composition C (58.94%), H (5.3%), N (24.55%), O (11.22%)
Atom Count36
PI7.94
Smilesn1cnc2c(c1N)c(n[nH]2)c1cc(c(cc1)OCC)OC
InChI1S/C14H15N5O2/c1-3-21-9-5-4-8(6-10(9)20-2)12-11-13(15)16-7-17-14(11)19-18-12/h4-7H,3H2,1-2H3,(H3,15,
16,17,18,19)
InChIKeyUVDQTDYLJGKKKD-UHFFFAOYSA-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
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Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 24905292
Drug Bank Link -
ChemSpider Link 24605167
ChEMBL Link CHEMBL1242471
 
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