Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004935
Inhibitor ClassQuinazoline
Molecule Name in Refrence Article15b
IUPAC Name6-methyl-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine
FormulaC16H12F3N3
Mass303.2818
Exact Mass303.098332
Composition C (63.36%), H (3.99%), F (18.79%), N (13.86%)
Atom Count34
PI10.01
Smilesc12cc(ccc1ncnc2Nc1cc(ccc1)C(F)(F)F)C
InChI1S/C16H12F3N3/c1-10-5-6-14-13(7-10)15(21-9-20-14)22-12-4-2-3-11(8-12)16(17,18)19/h2-9H,1H3,(H,20,21,
22)
InChIKeyNFEUTOJRUZZNQS-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
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 721010
Drug Bank Link -
ChemSpider Link 629391
ChEMBL Link CHEMBL602584
 
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