Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003460
Inhibitor ClassDiazepine
Molecule Name in Refrence Article3s compound
IUPAC Name9-(2-fluorophenyl)-2,4,5,8-tetraazatricyclo[8.4.0.0^{3,7}]tetradeca-1(10),3,6,8,11,13-hexaene-12-carbonitrile
FormulaC17H10FN5
Mass303.2932
Exact Mass303.0920236
Composition C (67.32%), H (3.32%), F (6.26%), N (23.09%)
Atom Count33
PI7.18
Smiles[nH]1c2c(c(nc3c1n[nH]c3)c1ccccc1F)cc(cc2)C#N
InChI1S/C17H10FN5/c18-13-4-2-1-3-11(13)16-12-7-10(8-19)5-6-14(12)22-17-15(21-16)9-20-23-17/h1-7,9H,(H2,20
,22,23)
InChIKeyHVAQMHFWXFSGJF-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
Reference20832307
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesFAK | CDK1 | CDK2 | KDR | PDGFr | CDK4 | Src | FGFr | ALL
Pub Chem Link -
Drug Bank Link -
ChemSpider Link 26364452
ChEMBL Link CHEMBL1257795
 
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