Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004828
Inhibitor ClassQuinazoline
Molecule Name in Refrence Article7(Q:2,X:B)
IUPAC NameN-(1-benzyl-1H-indazol-5-yl)-6,7-dimethoxyquinazolin-4-amine
FormulaC24H21N5O2
Mass411.4558
Exact Mass411.1695249
Composition C (70.06%), H (5.14%), N (17.02%), O (7.78%)
Atom Count52
PI10.21
Smilesc1c(c(cc2c1c(ncn2)Nc1ccc2n(ncc2c1)Cc1ccccc1)OC)OC
InChI1S/C24H21N5O2/c1-30-22-11-19-20(12-23(22)31-2)25-15-26-24(19)28-18-8-9-21-17(10-18)13-27-29(21)14-16
-6-4-3-5-7-16/h3-13,15H,14H2,1-2H3,(H,25,26,28)
InChIKeyYILRBOLKDDWRKU-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
Reference11378364
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 44279443
Drug Bank Link -
ChemSpider Link 23127576
ChEMBL Link CHEMBL416031
 
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