| General Property |
| Molceule ID (DB) | EGIN0001660 |
| Inhibitor Class | Tyrphostin |
| Molecule Name in Refrence Article | 5 compound |
| IUPAC Name | 3-{[4-(2,2-dicyanoeth-1-en-1-yl)phenyl]carbamoyl}propanoic acid |
| Formula | C14H11N3O3 |
| Mass | 269.2554 |
| Exact Mass | 269.0800412 |
| Composition | C (62.45%), H (4.12%), N (15.61%), O (17.83%) |
| Atom Count | 31 |
| PI | No isoelectric point. |
| Smiles | c1(ccc(cc1)NC(=O)CCC(=O)O)C=C(C#N)C#N |
| InChI | 1S/C14H11N3O3/c15-8-11(9-16)7-10-1-3-12(4-2-10)17-13(18)5-6-14(19)20/h1-4,7H,5-6H2,(H,17,18)(H,19,20
) |
| InChIKey | VNUISCLXMOOGIR-UHFFFAOYSA-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 | 2552117 |
| 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 |
5328782
|
| Drug Bank Link | - |
| ChemSpider Link | 4485944 |
| ChEMBL Link | CHEMBL307248 |
