Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001165
Inhibitor ClassAzaspiro-octane
Molecule Name in Refrence Article11 compound
IUPAC Name(6S,7S)-N-hydroxy-6-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)carbonyl]-5-azaspiro[2.5]octane-7-carboxamide
FormulaC20H25N3O3
Mass355.4308
Exact Mass355.1895917
Composition C (67.58%), H (7.09%), N (11.82%), O (13.5%)
Atom Count51
PI8.36
Smiles[C@H]1([C@H](NCC2(C1)CC2)C(=O)N1CCC(=CC1)c1ccccc1)C(=O)NO
InChI1S/C20H25N3O3/c24-18(22-26)16-12-20(8-9-20)13-21-17(16)19(25)23-10-6-15(7-11-23)14-4-2-1-3-5-14/h1-6
,16-17,21,26H,7-13H2,(H,22,24)/t16-,17-/m0/s1
InChIKeySCOVLRMEIYKGOU-IRXDYDNUSA-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
Reference17256836
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesADAM-10 | MMP-1 | MMP-2 | MMP-3 | MMP-9 | ALL
Pub Chem Link 16108939
Drug Bank Link -
ChemSpider Link 17266356
ChEMBL Link CHEMBL373532
 
TOP