Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000669
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article4a compound
IUPAC NameN-benzylpyrido[4,3-d]pyrimidin-4-amine
FormulaC14H12N4
Mass236.2719
Exact Mass236.1061964
Composition C (71.17%), H (5.12%), N (23.71%)
Atom Count30
PI11.38
Smilesc12c(ccnc1)ncnc2NCc1ccccc1
InChI1S/C14H12N4/c1-2-4-11(5-3-1)8-16-14-12-9-15-7-6-13(12)17-10-18-14/h1-7,9-10H,8H2,(H,16,17,18)
InChIKeyXZPCYVKAGQFORE-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
Reference8627606
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 4485412
ChEMBL Link CHEMBL54784
 
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