| General Property |
| Molceule ID (DB) | EGIN0003547 |
| Inhibitor Class | Tyrphostin |
| Molecule Name in Refrence Article | 16 (AG1292) |
| IUPAC Name | (2E)-2-cyano-N-{3-[(2E)-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)prop-2-enamido]propyl}-3-(3,4-dihydroxy-5-nitrophenyl)prop-2-enamide |
| Formula | C23H18N6O10 |
| Mass | 538.4232 |
| Exact Mass | 538.1084408 |
| Composition | C (51.31%), H (3.37%), N (15.61%), O (29.72%) |
| Atom Count | 57 |
| PI | 2.75 |
| Smiles | c1([N+](=O)[O-])c(c(cc(/C=C(/C(=O)NCCCNC(=O)/C(=C/c2cc([N+](=O)[O-])c(c(c2)O)O)/C#N)C#N)c1)O)O |
| InChI | 1S/C23H18N6O10/c24-10-14(4-12-6-16(28(36)37)20(32)18(30)8-12)22(34)26-2-1-3-27-23(35)15(11-25)5-13-7
-17(29(38)39)21(33)19(31)9-13/h4-9,30-33H,1-3H2,(H,26,34)(H,27,35)/b14-4+,15-5+ |
| InChIKey | ACNOKHXCQQGNOV-VHUAAIQRSA-N |
| 2D Structure |  | Structure Backbone |  |
|
| 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 | 8960549 |
| 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 |
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| Drug Bank Link | - |
| ChemSpider Link | 4801662 |
| ChEMBL Link | CHEMBL144632 |
