Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000736
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article8a
IUPAC NameN-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine
FormulaC16H14IN3O2
Mass407.2057
Exact Mass407.0130701
Composition C (47.19%), H (3.47%), I (31.16%), N (10.32%), O (7.86%)
Atom Count36
PI10.34
Smilesc12c(cc(c(c1)OC)OC)ncnc2Nc1cccc(c1)I
InChI1S/C16H14IN3O2/c1-21-14-7-12-13(8-15(14)22-2)18-9-19-16(12)20-11-5-3-4-10(17)6-11/h3-9H,1-2H3,(H,18,
19,20)
InChIKeyFGCLAQLIXMAIHT-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
Reference8879541 | 8568816 | 16279804 |
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 5328201
Drug Bank Link -
ChemSpider Link 4485366
ChEMBL Link CHEMBL96065
 
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