Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0005002
Inhibitor ClassIso-quinoline
Molecule Name in Refrence Article5b
IUPAC Name-
FormulaC19H15NO3
Mass305.3273
Exact Mass305.105193351
Composition C (74.74%), H (4.95%), N (4.59%), O (15.72%)
Atom Count38
PI-
Smiles[H]C#CC1=C([H])C(=C([H])C([H])=C1[H])N1C([H])=C([H])C2=C(C(OC([H])([H])[H])=C([H])C(OC([H])([H])[H])=C2[H])C1=O
InChI1S/C19H15NO3/c1-4-13-6-5-7-15(10-13)20-9-8-14-11-16(22-2)12-17(23-3)18(14)19(20)21/h1,5-12H,2-3H3
InChIKeyMGROHPNMUUDFSY-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
Reference24094432
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 28647184
ChEMBL Link CHEMBL2148044
 
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