Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001012
Inhibitor ClassPyrrolo-pyrimidine
Molecule Name in Refrence Article46 compound
IUPAC NameN-cyclohexyl-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
FormulaC14H20N4
Mass244.3354
Exact Mass244.1687967
Composition C (68.82%), H (8.25%), N (22.93%)
Atom Count38
PI10.93
Smilesn1cnc2c(c1NC1CCCCC1)c(c([nH]2)C)C
InChI1S/C14H20N4/c1-9-10(2)17-13-12(9)14(16-8-15-13)18-11-6-4-3-5-7-11/h8,11H,3-7H2,1-2H3,(H2,15,16,17,18
)
InChIKeyMNMIACDKHXNMKX-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
Reference8691423
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 10538285
Drug Bank Link -
ChemSpider Link 8713676
ChEMBL Link CHEMBL419635
 
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