General Property |
Molceule ID (DB) | EGIN0001242 |
Inhibitor Class | Tyrphostin |
Molecule Name in Refrence Article | AG933 |
IUPAC Name | (2E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-[(4-hydroxyphenyl)methyl]prop-2-enamide |
Formula | C17H14N2O4 |
Mass | 310.3041 |
Exact Mass | 310.0953569 |
Composition | C (65.8%), H (4.55%), N (9.03%), O (20.62%) |
Atom Count | 37 |
PI | 3.72 |
Smiles | c1c(c(ccc1/C=C(C#N)/C(=O)NCc1ccc(cc1)O)O)O |
InChI | 1S/C17H14N2O4/c18-9-13(7-12-3-6-15(21)16(22)8-12)17(23)19-10-11-1-4-14(20)5-2-11/h1-8,20-22H,10H2,(H
,19,23)/b13-7+ |
InChIKey | ANNOGSJJXIDSKS-NTUHNPAUSA-N |
2D Structure | ![](./image/EGIN0001242.png) | Structure Backbone | ![](./frame/f_EGIN0001242.png) |
|
View Structure in Jmol | Click to view 3 d structure Download Mol File |
Drug Like Property | Druglikeliness |
Symmetry & Geometry | Symmetry And Geometrical Information |
Activity & Binding | Activity against isoform and covalant binding information |
Topological Properties | Descriptors |
Reference | 8098709 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
44361640
|
Drug Bank Link | - |
ChemSpider Link | 23217690 |
ChEMBL Link | CHEMBL143805 |