Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001971
Inhibitor ClassQuinazoline
Molecule Name in Refrence Article20 compound
IUPAC Name4-(5-bromo-1H-indol-3-yl)-6,7-dimethoxyquinazoline
FormulaC18H14BrN3O2
Mass384.227
Exact Mass383.0269394
Composition C (56.27%), H (3.67%), Br (20.8%), N (10.94%), O (8.33%)
Atom Count38
PI8.44
Smilesc1(c(cc2c(c1)ncnc2c1c[nH]c2c1cc(cc2)Br)OC)OC
InChI1S/C18H14BrN3O2/c1-23-16-6-12-15(7-17(16)24-2)21-9-22-18(12)13-8-20-14-4-3-10(19)5-11(13)14/h3-9,20H
,1-2H3
InChIKeyMWBJNWJINFGNLQ-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
Reference17981366
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 11696664
Drug Bank Link -
ChemSpider Link 9871389
ChEMBL Link CHEMBL473320
 
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