Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003663
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article5h compound
IUPAC Name4-N-(3-bromophenyl)-6-N-[2-(dimethylamino)ethyl]pyrido[3,4-d]pyrimidine-4,6-diamine
FormulaC17H19BrN6
Mass387.277
Exact Mass386.0854573
Composition C (52.72%), H (4.95%), Br (20.63%), N (21.7%)
Atom Count43
PI11.92
Smilesc1(c2c(ncn1)cnc(c2)NCCN(C)C)Nc1cc(Br)ccc1
InChI1S/C17H19BrN6/c1-24(2)7-6-19-16-9-14-15(10-20-16)21-11-22-17(14)23-13-5-3-4-12(18)8-13/h3-5,8-11H,6-
7H2,1-2H3,(H,19,20)(H,21,22,23)
InChIKeyRMBTVBFZJFUISC-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
Reference9513602
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesc-Src | IR | PDGFR | FGFR | PDGFR | FGFR | c-Src | ALL
Pub Chem Link -
Drug Bank Link -
ChemSpider Link 4485519
ChEMBL Link CHEMBL162034
 
TOP