Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002713
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article8r compound
IUPAC Name4-N-{[3-(dimethylamino)phenyl]methyl}pyrido[4,3-d]pyrimidine-4,7-diamine
FormulaC16H18N6
Mass294.3543
Exact Mass294.1592946
Composition C (65.29%), H (6.16%), N (28.55%)
Atom Count40
PI11.63
Smilesc12c(ncnc1cc(nc2)N)NCc1cc(N(C)C)ccc1
InChI1S/C16H18N6/c1-22(2)12-5-3-4-11(6-12)8-19-16-13-9-18-15(17)7-14(13)20-10-21-16/h3-7,9-10H,8H2,1-2H3,
(H2,17,18)(H,19,20,21)
InChIKeyNUNYTOSAJZDUSJ-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
Reference7562908
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 5328094
Drug Bank Link -
ChemSpider Link 4485261
ChEMBL Link CHEMBL333045
 
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