Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000677
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article5g compound
IUPAC Name4-N-(3-bromophenyl)-7-N,7-N-dimethylpyrido[4,3-d]pyrimidine-4,7-diamine
FormulaC15H14BrN5
Mass344.209
Exact Mass343.0432581
Composition C (52.34%), H (4.1%), Br (23.21%), N (20.35%)
Atom Count35
PI10.1
Smilesc12c(cc(nc1)N(C)C)ncnc2Nc1cccc(c1)Br
InChI1S/C15H14BrN5/c1-21(2)14-7-13-12(8-17-14)15(19-9-18-13)20-11-5-3-4-10(16)6-11/h3-9H,1-2H3,(H,18,19,2
0)
InChIKeyFKFFXIBNVYSRTJ-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 | 9397172 |
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 5328253
Drug Bank Link -
ChemSpider Link 4485418
ChEMBL Link CHEMBL53428
 
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