Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0005038
Inhibitor ClassQuinazoline
Molecule Name in Refrence Article8
IUPAC NameN‐(3‐phenylphenyl)‐2H‐[1,3]dioxolo[4,5‐g]quinazolin‐8‐amine
FormulaC22H17N3O2
Mass355.3893
Exact Mass355.132076803
Composition C (74.35%), H (4.82%), N (11.82%), O (9%)
Atom Count44
PI10.39
Smiles[H]N(C1=NC([H])=NC2=C([H])C3=C(OC([H])([H])C([H])([H])O3)C([H])=C12)C1=C([H])C([H])=C([H])C(=C1[H])C1=C([H])C([H])=C([H])C([H])=C1[H]
InChI1S/C22H17N3O2/c1-2-5-15(6-3-1)16-7-4-8-17(11-16)25-22-18-12-20-21(27-10-9-26-20)13-19(18)23-14-24-22
/h1-8,11-14H,9-10H2,(H,23,24,25)
InChIKey FSFYBWMHVKFOOV-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
Reference23900004
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesFGFR-1 | VEGFR-2 | PDGFRβ | Src | Abl | ALL
Pub Chem Link 42596931
Drug Bank Link -
ChemSpider Link -
ChEMBL Link -
 
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