| General Property |
| Molceule ID (DB) | EGIN0001252 |
| Inhibitor Class | Tyrphostin |
| Molecule Name in Refrence Article | 7 compound |
| IUPAC Name | (2E)-3-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-hydroxy-5-methoxyphenyl}-2-cyanoprop-2-enamide |
| Formula | C19H15N3O3S2 |
| Mass | 397.471 |
| Exact Mass | 397.0554827 |
| Composition | C (57.41%), H (3.8%), N (10.57%), O (12.08%), S (16.13%) |
| Atom Count | 42 |
| PI | 4.79 |
| Smiles | c1(cc(c(c(c1)OC)O)CSc1nc2c(s1)cccc2)/C=C(/C(=O)N)C#N |
| InChI | 1S/C19H15N3O3S2/c1-25-15-8-11(6-12(9-20)18(21)24)7-13(17(15)23)10-26-19-22-14-4-2-3-5-16(14)27-19/h2
-8,23H,10H2,1H3,(H2,21,24)/b12-6+ |
| InChIKey | KXDONFLNGBQLTN-WUXMJOGZSA-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 | 7902440 | 7902440 | 8098709 | |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | Insulin R | PDGFR | c-Abl | ALL |
| Pub Chem Link |
6091659
|
| Drug Bank Link | - |
| ChemSpider Link | 4804551 |
| ChEMBL Link | CHEMBL118109 |
