Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003488
Inhibitor ClassPyrrolo-triazine
Molecule Name in Refrence Article12 compound
IUPAC Name6-(5-methyl-1,3,4-oxadiazol-2-yl)-5-(propan-2-yl)-N-{1H-pyrrolo[2,3-b]pyridin-5-yl}pyrrolo[2,1-f][1,2,4]triazin-4-amine
FormulaC19H18N8O
Mass374.3992
Exact Mass374.1603572
Composition C (60.95%), H (4.85%), N (29.93%), O (4.27%)
Atom Count46
PI9.63
Smilesn1cnc(c2n1cc(c2C(C)C)c1nnc(o1)C)Nc1cc2c(nc1)[nH]cc2
InChI1S/C19H18N8O/c1-10(2)15-14(19-26-25-11(3)28-19)8-27-16(15)18(22-9-23-27)24-13-6-12-4-5-20-17(12)21-7
-13/h4-10H,1-3H3,(H,20,21)(H,22,23,24)
InChIKeyLQNDDQQRHZEHDD-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
Reference18395443
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesFGFR1 | JAK3 | LCK | PDGFR beta | PKC alpha | VEGFR2 | ALL
Pub Chem Link 44449577
Drug Bank Link -
ChemSpider Link 23316251
ChEMBL Link CHEMBL258694
 
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