Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004863
Inhibitor ClassUnknown
Molecule Name in Refrence Article4
IUPAC Name4-bromo-2-[(E)-N-[4-(piperidine-1-sulfonyl)phenyl]carboximidoyl]phenol
FormulaC18H19BrN2O3S
Mass423.324
Exact Mass422.0299758
Composition C (51.07%), H (4.52%), Br (18.88%), N (6.62%), O (11.34%), S (7.57%)
Atom Count44
PI4.45
SmilesC1CCCN(C1)S(=O)(=O)c1ccc(cc1)/N=C/c1cc(ccc1O)Br
InChI1S/C18H19BrN2O3S/c19-15-4-9-18(22)14(12-15)13-20-16-5-7-17(8-6-16)25(23,24)21-10-2-1-3-11-21/h4-9,12
-13,22H,1-3,10-11H2/b20-13+
InChIKeyZOQWQEXFRVBSMB-DEDYPNTBSA-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
Reference22595177
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 15749664
Drug Bank Link -
ChemSpider Link 12022252
ChEMBL Link -
 
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