Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004455
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article5o
IUPAC Name8-{[4-(benzyloxy)phenyl]amino}-1-[3-(morpholin-4-yl)propyl]-1H,2H-[1,3]oxazolo[4,5-g]quinazolin-2-one
FormulaC29H29N5O4
Mass511.5717
Exact Mass511.2219544
Composition C (68.09%), H (5.71%), N (13.69%), O (12.51%)
Atom Count67
PI11.5
SmilesC1OCCN(C1)CCCn1c(=O)oc2c1cc1c(c2)ncnc1Nc1ccc(cc1)OCc1ccccc1
InChI1S/C29H29N5O4/c35-29-34(12-4-11-33-13-15-36-16-14-33)26-17-24-25(18-27(26)38-29)30-20-31-28(24)32-22
-7-9-23(10-8-22)37-19-21-5-2-1-3-6-21/h1-3,5-10,17-18,20H,4,11-16,19H2,(H,30,31,32)
InChIKeyRJARHRSDCQNMIU-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
Reference22818848
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 -
Drug Bank Link -
ChemSpider Link 28522143
ChEMBL Link -
 
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