Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000706
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article2a
IUPAC NameN-(3-chlorophenyl)quinazolin-4-amine
FormulaC14H10ClN3
Mass255.702
Exact Mass255.056325
Composition C (65.76%), H (3.94%), Cl (13.86%), N (16.43%)
Atom Count28
PI9.8
Smilesc12c(cccc1)ncnc2Nc1cccc(c1)Cl
InChI1S/C14H10ClN3/c15-10-4-3-5-11(8-10)18-14-12-6-1-2-7-13(12)16-9-17-14/h1-9H,(H,16,17,18)
InChIKeyZKKVUIPXPPDIRD-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
Reference8879541 | 7658435 | 8568816 | 8825124 | 10639288 |
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 128872
Drug Bank Link -
ChemSpider Link 114201
ChEMBL Link CHEMBL329672
 
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