| General Property |
| Molceule ID (DB) | EGIN0002817 |
| Inhibitor Class | Tyrphostin |
| Molecule Name in Refrence Article | 44 compound |
| IUPAC Name | (2E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-[(1R)-1-phenylethyl]prop-2-enamide |
| Formula | C18H16N2O3 |
| Mass | 308.3312 |
| Exact Mass | 308.1160924 |
| Composition | C (70.12%), H (5.23%), N (9.09%), O (15.57%) |
| Atom Count | 39 |
| PI | 3.66 |
| Smiles | c1c(cccc1)[C@H](NC(=O)/C(=C/c1cc(c(cc1)O)O)/C#N)C |
| InChI | 1S/C18H16N2O3/c1-12(14-5-3-2-4-6-14)20-18(23)15(11-19)9-13-7-8-16(21)17(22)10-13/h2-10,12,21-22H,1H3
,(H,20,23)/b15-9+/t12-/m1/s1 |
| InChIKey | UMGQVUWXNOJOSJ-KMHUVPDISA-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 | 1676428 |
| 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 |
5328772
|
| Drug Bank Link | - |
| ChemSpider Link | 4485934 |
| ChEMBL Link | CHEMBL55979 |
