Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000733
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article5a
IUPAC NameN-(3-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine
FormulaC16H14FN3O2
Mass299.2997
Exact Mass299.1070049
Composition C (64.21%), H (4.71%), F (6.35%), N (14.04%), O (10.69%)
Atom Count36
PI10.12
Smilesc12c(cc(c(c1)OC)OC)ncnc2Nc1cccc(c1)F
InChI1S/C16H14FN3O2/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)
InChIKeyDFWBDVRBHHFDNZ-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 1474883
Drug Bank Link -
ChemSpider Link 1216709
ChEMBL Link CHEMBL94431
 
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