Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003300
Inhibitor ClassPyrrolo-triazine
Molecule Name in Refrence Article13 compound
IUPAC Name2-methyl-5-({pyrrolo[2,1-f][1,2,4]triazin-4-yl}amino)phenol
FormulaC13H12N4O
Mass240.2606
Exact Mass240.101111
Composition C (64.99%), H (5.03%), N (23.32%), O (6.66%)
Atom Count30
PI6.44
Smilesc12c(ncnn1ccc2)Nc1cc(c(cc1)C)O
InChI1S/C13H12N4O/c1-9-4-5-10(7-12(9)18)16-13-11-3-2-6-17(11)15-8-14-13/h2-8,18H,1H3,(H,14,15,16)
InChIKeyQVHFAUADDZADAN-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
Reference15267243
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesVEGFR2 | ALL
Pub Chem Link 9794758
Drug Bank Link -
ChemSpider Link 7970525
ChEMBL Link CHEMBL185853
 
TOP