Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001833
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article1a
IUPAC Name4-N-(3-chlorophenyl)quinazoline-4,6-diamine
FormulaC14H11ClN4
Mass270.717
Exact Mass270.0672241
Composition C (62.11%), H (4.1%), Cl (13.1%), N (20.7%)
Atom Count30
PI10.5
Smilesc1(c2c(ncn1)ccc(c2)N)Nc1cc(Cl)ccc1
InChI1S/C14H11ClN4/c15-9-2-1-3-11(6-9)19-14-12-7-10(16)4-5-13(12)17-8-18-14/h1-8H,16H2,(H,17,18,19)
InChIKeyAWAYNEMCHILZCF-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
Reference22309911 | 21763148 | 13678409 | 15686928 | 16759097 | 17472358 |
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 11807783
Drug Bank Link -
ChemSpider Link 9982448
ChEMBL Link CHEMBL343352
 
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