Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003000
Inhibitor ClassIndole
Molecule Name in Refrence Article8 compound
IUPAC Name4-(2-{[3-(2-aminoethyl)-1-{[4-(3-methoxyphenyl)phenyl]methyl}-1H-indol-5-yl]oxy}ethyl)phenol
FormulaC32H32N2O3
Mass492.6081
Exact Mass492.2412929
Composition C (78.02%), H (6.55%), N (5.69%), O (9.74%)
Atom Count69
PI9.91
Smilesc1c(ccc2c1c(cn2Cc1ccc(cc1)c1cc(ccc1)OC)CCN)OCCc1ccc(cc1)O
InChI1S/C32H32N2O3/c1-36-29-4-2-3-26(19-29)25-9-5-24(6-10-25)21-34-22-27(15-17-33)31-20-30(13-14-32(31)34
)37-18-16-23-7-11-28(35)12-8-23/h2-14,19-20,22,35H,15-18,21,33H2,1H3
InChIKeyZVAZARFFXQNPCG-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
Reference20456957
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesVEGFR2 | IGF1R | VEGFR3 | ALL
Pub Chem Link -
Drug Bank Link -
ChemSpider Link -
ChEMBL Link CHEMBL1199045
 
TOP