Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002521
Inhibitor ClassTriazole
Molecule Name in Refrence Article4h compound
IUPAC Name(2R)-2-[4-(4-methylphenyl)-1H-1,2,3-triazol-1-yl]cyclohexan-1-one
FormulaC15H17N3O
Mass255.315
Exact Mass255.1371622
Composition C (70.56%), H (6.71%), N (16.46%), O (6.27%)
Atom Count36
PI9.25
Smiles[C@H]1(n2cc(nn2)c2ccc(cc2)C)C(=O)CCCC1
InChI1S/C15H17N3O/c1-11-6-8-12(9-7-11)13-10-18(17-16-13)14-4-2-3-5-15(14)19/h6-10,14H,2-5H2,1H3/t14-/m1/s
1
InChIKeyGYLRZQXVSISSMM-CQSZACIVSA-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
Reference21084189
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesSRC | Cck | Lck | ALL
Pub Chem Link -
Drug Bank Link -
ChemSpider Link 26381645
ChEMBL Link CHEMBL1642294
 
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