Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002381
Inhibitor ClassImidazo-thiazole
Molecule Name in Refrence Article4 compound
IUPAC NameN-{3-[5-(2-amino-1H-1,3-benzodiazol-6-yl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}-2-chlorobenzamide
FormulaC25H17ClN6OS
Mass484.96
Exact Mass484.0873076
Composition C (61.92%), H (3.53%), Cl (7.31%), N (17.33%), O (3.3%), S (6.61%)
Atom Count51
PI9.4
Smilesn1c(c(n2c1scc2)c1ccc2c(c1)[nH]c(n2)N)c1cc(ccc1)NC(=O)c1ccccc1Cl
InChI1S/C25H17ClN6OS/c26-18-7-2-1-6-17(18)23(33)28-16-5-3-4-14(12-16)21-22(32-10-11-34-25(32)31-21)15-8-9
-19-20(13-15)30-24(27)29-19/h1-13H,(H,28,33)(H3,27,29,30)
InChIKeyXQFKEPZMCJQYEV-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
Reference20346655
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesIGF1R |
Pub Chem Link 46886244
Drug Bank Link -
ChemSpider Link 24679098
ChEMBL Link CHEMBL1093486
 
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