Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004819
Inhibitor ClassIndole
Molecule Name in Refrence Article8
IUPAC Name(1Z,2R)-2-amino-1-(1H-indol-3-ylmethylidene)propane-1,3,3-tricarbonitrile
FormulaC15H11N5
Mass261.2813
Exact Mass261.1014454
Composition C (68.95%), H (4.24%), N (26.8%)
Atom Count31
PI5.53
Smilesc1cccc2c1c(c[nH]2)/C=C(/[C@H](N)C(C#N)C#N)C#N
InChI1S/C15H11N5/c16-6-10(15(19)12(7-17)8-18)5-11-9-20-14-4-2-1-3-13(11)14/h1-5,9,12,15,20H,19H2/b10-5+/t
15-/m0/s1
InChIKeyNTSBESMGQOQOQD-RNOHYWCBSA-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
Reference8667360
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesPDGFR |
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