Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003232
Inhibitor ClassPyrrolo-pyrimidine
Molecule Name in Refrence Article4n compound
IUPAC Namemethyl 2-[(3R)-3-[4-amino-5-(3-methoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]pyrrolidin-1-yl]acetate
FormulaC20H23N5O3
Mass381.4283
Exact Mass381.1800896
Composition C (62.98%), H (6.08%), N (18.36%), O (12.58%)
Atom Count51
PINo isoelectric point.
Smilesc12n(cc(c1c(ncn2)N)c1cc(OC)ccc1)[C@H]1CN(CC(=O)OC)CC1
InChI1S/C20H23N5O3/c1-27-15-5-3-4-13(8-15)16-10-25(20-18(16)19(21)22-12-23-20)14-6-7-24(9-14)11-17(26)28-
2/h3-5,8,10,12,14H,6-7,9,11H2,1-2H3,(H2,21,22,23)/t14-/m1/s1
InChIKeyIUHCHNLQYCBXNR-CQSZACIVSA-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 -
Drug Bank Link -
ChemSpider Link 23238673
ChEMBL Link CHEMBL355891
 
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