Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002383
Inhibitor ClassImidazo-thiazole
Molecule Name in Refrence Article6 compound
IUPAC Name2-chloro-N-(3-{5-[2-(phenylamino)pyrimidin-4-yl]imidazo[2,1-b][1,3]thiazol-6-yl}phenyl)benzamide
FormulaC28H19ClN6OS
Mass523.008
Exact Mass522.1029577
Composition C (64.3%), H (3.66%), Cl (6.78%), N (16.07%), O (3.06%), S (6.13%)
Atom Count56
PI6.8
Smilesn1c(c(n2c1scc2)c1ccnc(n1)Nc1ccccc1)c1cc(ccc1)NC(=O)c1ccccc1Cl
InChI1S/C28H19ClN6OS/c29-22-12-5-4-11-21(22)26(36)31-20-10-6-7-18(17-20)24-25(35-15-16-37-28(35)34-24)23-
13-14-30-27(33-23)32-19-8-2-1-3-9-19/h1-17H,(H,31,36)(H,30,32,33)
InChIKeyBIHMIKVTIYXXKN-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 46886310
Drug Bank Link -
ChemSpider Link 24679826
ChEMBL Link CHEMBL1093815
 
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