Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002036
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article7n compound
IUPAC NameN-(3,4-dimethoxyphenyl)-3-(3-methoxypropyl)-2-propyl-3H-imidazo[4,5-g]quinazolin-8-amine
FormulaC24H29N5O3
Mass435.5188
Exact Mass435.2270398
Composition C (66.19%), H (6.71%), N (16.08%), O (11.02%)
Atom Count61
PI10.84
Smilesc1(nc2cc3c(Nc4cc(c(cc4)OC)OC)ncnc3cc2n1CCCOC)CCC
InChI1S/C24H29N5O3/c1-5-7-23-28-19-13-17-18(14-20(19)29(23)10-6-11-30-2)25-15-26-24(17)27-16-8-9-21(31-3)
22(12-16)32-4/h8-9,12-15H,5-7,10-11H2,1-4H3,(H,25,26,27)
InChIKeyVAZZUMPQOWAWOY-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 44565412
Drug Bank Link -
ChemSpider Link 23336798
ChEMBL Link CHEMBL473009
 
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