Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003563
Inhibitor ClassDiselenobis-indole
Molecule Name in Refrence Article22 compound
IUPAC Name2-[(3-carboxy-1-methyl-1H-indol-2-yl)diselanyl]-1-methyl-1H-indole-3-carboxylic acid
FormulaC20H16N2O4Se2
Mass506.27
Exact Mass507.9440507
Composition C (47.45%), H (3.19%), N (5.53%), O (12.64%), Se (31.19%)
Atom Count44
PINo isoelectric point.
Smilesc1(c(c2c(n1C)cccc2)C(=O)O)[Se][Se]c1c(c2c(n1C)cccc2)C(=O)O
InChI1S/C20H16N2O4Se2/c1-21-13-9-5-3-7-11(13)15(19(23)24)17(21)27-28-18-16(20(25)26)12-8-4-6-10-14(12)22(
18)2/h3-10H,1-2H3,(H,23,24)(H,25,26)
InChIKeyHNEORRPIDMAPCB-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
Reference9046331
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesPDGFr | v-src | ALL
Pub Chem Link -
Drug Bank Link -
ChemSpider Link 4485266
ChEMBL Link CHEMBL334915
 
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