Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003215
Inhibitor ClassAnilino-quinoline
Molecule Name in Refrence Article20a compound
IUPAC Name8-[(2-chloro-5-methoxyphenyl)amino]-3-[2-(morpholin-4-yl)ethyl]-3H-imidazo[4,5-g]quinoline-7-carbonitrile
FormulaC24H23ClN6O2
Mass462.931
Exact Mass462.1571017
Composition C (62.27%), H (5.01%), Cl (7.66%), N (18.15%), O (6.91%)
Atom Count56
PI11.04
Smilesc1(c2c(cc3n(cnc3c2)CCN2CCOCC2)ncc1C#N)Nc1cc(ccc1Cl)OC
InChI1S/C24H23ClN6O2/c1-32-17-2-3-19(25)21(10-17)29-24-16(13-26)14-27-20-12-23-22(11-18(20)24)28-15-31(23
)5-4-30-6-8-33-9-7-30/h2-3,10-12,14-15H,4-9H2,1H3,(H,27,29)
InChIKeyCEQOEOYCGNLAKF-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 5330120
Drug Bank Link -
ChemSpider Link 4487271
ChEMBL Link CHEMBL92339
 
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