Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000616
Inhibitor ClassBenzamide
Molecule Name in Refrence Article1d compound
IUPAC Name2-amino-4,5-dimethoxy-N-[3-(trifluoromethyl)phenyl]benzamide
FormulaC16H15F3N2O3
Mass340.2971
Exact Mass340.103477
Composition C (56.47%), H (4.44%), F (16.75%), N (8.23%), O (14.1%)
Atom Count39
PI6.99
Smilesc1(c(cc(c(c1)OC)OC)N)C(=O)Nc1cccc(c1)C(F)(F)F
InChI1S/C16H15F3N2O3/c1-23-13-7-11(12(20)8-14(13)24-2)15(22)21-10-5-3-4-9(6-10)16(17,18)19/h3-8H,20H2,1-2
H3,(H,21,22)
InChIKeyRAALDHNHOWDKTR-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
Reference15186837
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 -
Drug Bank Link -
ChemSpider Link 23166002
ChEMBL Link CHEMBL77454
 
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