Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002708
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article8m compound
IUPAC Name4-N-[(4-methoxyphenyl)methyl]pyrido[4,3-d]pyrimidine-4,7-diamine
FormulaC15H15N5O
Mass281.3125
Exact Mass281.1276601
Composition C (64.04%), H (5.37%), N (24.9%), O (5.69%)
Atom Count36
PI11.62
Smilesc12c(ncnc1cc(nc2)N)NCc1ccc(cc1)OC
InChI1S/C15H15N5O/c1-21-11-4-2-10(3-5-11)7-18-15-12-8-17-14(16)6-13(12)19-9-20-15/h2-6,8-9H,7H2,1H3,(H2,1
6,17)(H,18,19,20)
InChIKeyWANNBVICBHCQGP-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 5328089
Drug Bank Link -
ChemSpider Link 4485256
ChEMBL Link CHEMBL125995
 
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