Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001567
Inhibitor ClassQuinazoline
Molecule Name in Refrence Article36 compound
IUPAC NameN-[(3,4-dimethoxyphenyl)methyl]-6-methylquinazolin-4-amine
FormulaC18H19N3O2
Mass309.3624
Exact Mass309.1477269
Composition C (69.88%), H (6.19%), N (13.58%), O (10.34%)
Atom Count42
PI11.99
Smilesc12c(ccc(c1)C)ncnc2NCc1ccc(c(c1)OC)OC
InChI1S/C18H19N3O2/c1-12-4-6-15-14(8-12)18(21-11-20-15)19-10-13-5-7-16(22-2)17(9-13)23-3/h4-9,11H,10H2,1-
3H3,(H,19,20,21)
InChIKeySMFBIPPLTAJQBN-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
Reference18702009
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 21002433
Drug Bank Link -
ChemSpider Link 20538033
ChEMBL Link -
 
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