Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000758
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article53 compound
IUPAC Name4-[(3-bromophenyl)amino]quinazoline-6,7-diol
FormulaC14H10BrN3O2
Mass332.152
Exact Mass330.9956392
Composition C (50.62%), H (3.03%), Br (24.06%), N (12.65%), O (9.63%)
Atom Count30
PI6.34
Smilesc12c(cc(c(c1)O)O)ncnc2Nc1cccc(c1)Br
InChI1S/C14H10BrN3O2/c15-8-2-1-3-9(4-8)18-14-10-5-12(19)13(20)6-11(10)16-7-17-14/h1-7,19-20H,(H,16,17,18)
InChIKeyCZMCXMIIVHUIPE-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
Reference7658435 | 8568816 | 8632415 |
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 -
Drug Bank Link -
ChemSpider Link 10762177
ChEMBL Link CHEMBL93032
 
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