Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003993
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article3e compound
IUPAC Name6,7-diethoxy-N-[3-(1,3-oxazol-4-yl)phenyl]quinazolin-4-amine
FormulaC21H20N4O3
Mass376.4085
Exact Mass376.1535405
Composition C (67.01%), H (5.36%), N (14.88%), O (12.75%)
Atom Count48
PI10.28
Smilesc12c(ncnc1cc(c(c2)OCC)OCC)Nc1cc(c2ncoc2)ccc1
InChI1S/C21H20N4O3/c1-3-27-19-9-16-17(10-20(19)28-4-2)22-12-23-21(16)25-15-7-5-6-14(8-15)18-11-26-13-24-1
8/h5-13H,3-4H2,1-2H3,(H,22,23,25)
InChIKeyIOCCYZUACQGGIM-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
Reference12190310
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesF16BP |
Pub Chem Link 10172616
Drug Bank Link -
ChemSpider Link 8348121
ChEMBL Link CHEMBL126996
 
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