Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002035
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article7m compound
IUPAC Name3-butyl-N-(4-methylphenyl)-2-(propan-2-yl)-3H-imidazo[4,5-g]quinazolin-8-amine
FormulaC23H27N5
Mass373.494
Exact Mass373.2266459
Composition C (73.96%), H (7.29%), N (18.75%)
Atom Count55
PI10.94
SmilesCCCCn1c(nc2cc3c(Nc4ccc(C)cc4)ncnc3cc12)C(C)C
InChI1S/C23H27N5/c1-5-6-11-28-21-13-19-18(12-20(21)27-23(28)15(2)3)22(25-14-24-19)26-17-9-7-16(4)8-10-17/
h7-10,12-15H,5-6,11H2,1-4H3,(H,24,25,26)
InChIKeyVZUUECYZNOGTQA-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
Reference18313807
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 25198680
Drug Bank Link -
ChemSpider Link 23336751
ChEMBL Link CHEMBL474384
 
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