Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002382
Inhibitor ClassImidazo-thiazole
Molecule Name in Refrence Article5 compound
IUPAC Name2-chloro-N-{3-[5-(pyridin-4-yl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}benzamide
FormulaC23H15ClN4OS
Mass430.909
Exact Mass430.0655095
Composition C (64.11%), H (3.51%), Cl (8.23%), N (13%), O (3.71%), S (7.44%)
Atom Count45
PI7.7
Smilesn1c(c(n2c1scc2)c1ccncc1)c1cc(ccc1)NC(=O)c1ccccc1Cl
InChI1S/C23H15ClN4OS/c24-19-7-2-1-6-18(19)22(29)26-17-5-3-4-16(14-17)20-21(15-8-10-25-11-9-15)28-12-13-30
-23(28)27-20/h1-14H,(H,26,29)
InChIKeyAWONUZFYKOTAIK-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
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Reported activity against other enzymesIGF1R |
Pub Chem Link 46886245
Drug Bank Link -
ChemSpider Link 24677734
ChEMBL Link CHEMBL1091613
 
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