Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001831
Inhibitor ClassThieno-pyridine
Molecule Name in Refrence Article56 compound
IUPAC Name2-methyl-N-{2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-yl}-1H-indol-5-amine
FormulaC27H26N4OS
Mass454.587
Exact Mass454.1827322
Composition C (71.34%), H (5.76%), N (12.32%), O (3.52%), S (7.05%)
Atom Count59
PI12.09
Smiless1c(cc2c1c(Nc1cc3cc([nH]c3cc1)C)ccn2)c1ccc(CN2CCOCC2)cc1
InChI1S/C27H26N4OS/c1-18-14-21-15-22(6-7-23(21)29-18)30-24-8-9-28-25-16-26(33-27(24)25)20-4-2-19(3-5-20)1
7-31-10-12-32-13-11-31/h2-9,14-16,29H,10-13,17H2,1H3,(H,28,30)
InChIKeyNWVUSUJOHOVKNG-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
Reference14684289
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesVEGFR |
Pub Chem Link 10434122
Drug Bank Link -
ChemSpider Link 8609548
ChEMBL Link CHEMBL311111
 
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