Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000624
Inhibitor ClassBenzamidine
Molecule Name in Refrence Article2b compound
IUPAC Name2-amino-N-(3-chlorophenyl)-4,5-dimethoxybenzene-1-carboximidamide
FormulaC15H16ClN3O2
Mass305.759
Exact Mass305.0931045
Composition C (58.92%), H (5.27%), Cl (11.6%), N (13.74%), O (10.47%)
Atom Count37
PINo isoelectric point.
Smilesc1(c(cc(c(c1)OC)OC)N)C(=N)Nc1cccc(c1)Cl
InChI1S/C15H16ClN3O2/c1-20-13-7-11(12(17)8-14(13)21-2)15(18)19-10-5-3-4-9(16)6-10/h3-8H,17H2,1-2H3,(H2,18
,19)
InChIKeyNTBZCROKMJWNDV-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 23165790
ChEMBL Link CHEMBL77897
 
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