Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004356
Inhibitor ClassNaphthyridine
Molecule Name in Refrence Article2a compound
IUPAC Name4-[(3-chloro-4-fluorophenyl)amino]-6-[(1H-imidazol-4-ylmethyl)amino]-1,7-naphthyridine-3-carbonitrile
FormulaC19H13ClFN7
Mass393.805
Exact Mass393.0904994
Composition C (57.95%), H (3.33%), Cl (9%), F (4.82%), N (24.9%)
Atom Count41
PI9.58
Smilesc12cc(ncc1ncc(c2Nc1cc(c(cc1)F)Cl)C#N)NCc1c[nH]cn1
InChI1S/C19H13ClFN7/c20-15-3-12(1-2-16(15)21)28-19-11(5-22)6-24-17-9-26-18(4-14(17)19)25-8-13-7-23-10-27-
13/h1-4,6-7,9-10H,8H2,(H,23,27)(H,24,28)(H,25,26)
InChIKeyXNLZFFPOXPLVPL-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
Reference17664070
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesPKC | S6 | p38 | MEK | p38 | PKA | ALL
Pub Chem Link -
Drug Bank Link -
ChemSpider Link -
ChEMBL Link CHEMBL220037
 
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