Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003233
Inhibitor ClassPyrrolo-pyrimidine
Molecule Name in Refrence Article4o compound
IUPAC Name2-[(3R)-3-[4-amino-5-(3-methoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]pyrrolidin-1-yl]acetamide
FormulaC19H22N6O2
Mass366.417
Exact Mass366.180424
Composition C (62.28%), H (6.05%), N (22.94%), O (8.73%)
Atom Count49
PI11.86
Smilesc12n(cc(c1c(ncn2)N)c1cc(OC)ccc1)[C@H]1CN(CC(=O)N)CC1
InChI1S/C19H22N6O2/c1-27-14-4-2-3-12(7-14)15-9-25(19-17(15)18(21)22-11-23-19)13-5-6-24(8-13)10-16(20)26/h
2-4,7,9,11,13H,5-6,8,10H2,1H3,(H2,20,26)(H2,21,22,23)/t13-/m1/s1
InChIKeySRVDBASMNUCPHD-CYBMUJFWSA-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
Reference11277536
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesc-Src | v-Abl | ALL
Pub Chem Link 23240660
Drug Bank Link -
ChemSpider Link 23238672
ChEMBL Link CHEMBL355322
 
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