Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000365
Inhibitor ClassQuinazoline
Molecule Name in Refrence Article1e compound
IUPAC Name5-[(3-methylphenyl)amino]-8-nitroquinazolin-4-ol
FormulaC15H12N4O3
Mass296.2808
Exact Mass296.0909403
Composition C (60.81%), H (4.08%), N (18.91%), O (16.2%)
Atom Count34
PI5.51
Smilesc12c(c(ccc1Nc1cc(ccc1)C)N(=O)=O)ncnc2O
InChI1S/C15H12N4O3/c1-9-3-2-4-10(7-9)18-11-5-6-12(19(21)22)14-13(11)15(20)17-8-16-14/h2-8,18H,1H3,(H,16,1
7,20)
InChIKeyHTHUEBBXXQOUEE-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
Reference15993078
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 -
Drug Bank Link -
ChemSpider Link 23335064
ChEMBL Link CHEMBL473083
 
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