Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003217
Inhibitor ClassAnilino-quinoline
Molecule Name in Refrence Article20c compound
IUPAC Name8-[(4-chloro-5-methoxy-2-methylphenyl)amino]-3-[2-(morpholin-4-yl)ethyl]-3H-imidazo[4,5-g]quinoline-7-carbonitrile
FormulaC25H25ClN6O2
Mass476.958
Exact Mass476.1727518
Composition C (62.95%), H (5.28%), Cl (7.43%), N (17.62%), O (6.71%)
Atom Count59
PI11.9
Smilesc1(c2c(cc3n(cnc3c2)CCN2CCOCC2)ncc1C#N)Nc1cc(c(cc1C)Cl)OC
InChI1S/C25H25ClN6O2/c1-16-9-19(26)24(33-2)12-20(16)30-25-17(13-27)14-28-21-11-23-22(10-18(21)25)29-15-32
(23)4-3-31-5-7-34-8-6-31/h9-12,14-15H,3-8H2,1-2H3,(H,28,30)
InChIKeyFIWABDXXOFQUGQ-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
Reference12217371
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesSrc |
Pub Chem Link 5330122
Drug Bank Link -
ChemSpider Link 4487273
ChEMBL Link CHEMBL330351
 
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