Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000921
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article32 compound
IUPAC NameN-{4-[(3-bromophenyl)amino]pyrido[3,4-d]pyrimidin-6-yl}ethene-1-sulfonamide
FormulaC15H12BrN5O2S
Mass406.257
Exact Mass404.989508
Composition C (44.35%), H (2.98%), Br (19.67%), N (17.24%), O (7.88%), S (7.89%)
Atom Count36
PI6.32
Smilesn1cnc2c(c1Nc1cccc(c1)Br)cc(nc2)NS(=O)(=O)C=C
InChI1S/C15H12BrN5O2S/c1-2-24(22,23)21-14-7-12-13(8-17-14)18-9-19-15(12)20-11-5-3-4-10(16)6-11/h2-9H,1H2,
(H,17,21)(H,18,19,20)
InChIKeyDECUBVXBHCLQNY-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
Reference11462982
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 5329093
Drug Bank Link -
ChemSpider Link 4486255
ChEMBL Link CHEMBL139095
 
TOP