Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001825
Inhibitor ClassThieno-pyridine
Molecule Name in Refrence Article50 compound
IUPAC NameN-{2-[4-(morpholin-4-ylmethyl)phenyl]thieno[3,2-b]pyridin-7-yl}-1H-indol-5-amine
FormulaC26H24N4OS
Mass440.56
Exact Mass440.1670821
Composition C (70.88%), H (5.49%), N (12.72%), O (3.63%), S (7.28%)
Atom Count56
PI12.04
Smiless1c(cc2c1c(Nc1cc3c([nH]cc3)cc1)ccn2)c1ccc(CN2CCOCC2)cc1
InChI1S/C26H24N4OS/c1-3-19(4-2-18(1)17-30-11-13-31-14-12-30)25-16-24-26(32-25)23(8-10-28-24)29-21-5-6-22-
20(15-21)7-9-27-22/h1-10,15-16,27H,11-14,17H2,(H,28,29)
InChIKeyJCKSFAJUCQVQOF-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 18382861
Drug Bank Link -
ChemSpider Link 13367465
ChEMBL Link CHEMBL312482
 
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