Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0005218
Inhibitor ClassPyrimidine
Molecule Name in Refrence Article11
IUPAC Name-
FormulaC24H20ClN5O2
Mass445.901
Exact Mass445.130552616
Composition C (64.65%), H (4.52%), Cl (7.95%), N (15.71%), O (7.18%)
Atom Count52
PI6.44
Smiles[H]C([H])=C([H])C(=O)N1C2=C(C([H])=C(OC([H])([H])[H])C(N([H])C3=NC([H])=C(Cl)C(=N3)C3=C([H])N([H])C4=C([H])C([H])=C([H])C([H])=C34)=C2[H])C([H])([H])C1([H])[H]
InChI1S/C24H20ClN5O2/c1-3-22(31)30-9-8-14-10-21(32-2)19(11-20(14)30)28-24-27-13-17(25)23(29-24)16-12-26-1
8-7-5-4-6-15(16)18/h3-7,10-13,26H,1,8-9H2,2H3,(H,27,28,29)
InChIKeyFHGXREVAXMGQHY-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
Reference23930994
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesNo activity data against other kinases present in database
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