| General Property |
| Molceule ID (DB) | EGIN0001638 |
| Inhibitor Class | Tyrphostin |
| Molecule Name in Refrence Article | 10 compound |
| IUPAC Name | (2E)-2-cyano-3-{4-hydroxy-3-methoxy-5-[(naphthalen-2-ylsulfanyl)methyl]phenyl}prop-2-enamide |
| Formula | C22H18N2O3S |
| Mass | 390.455 |
| Exact Mass | 390.1038131 |
| Composition | C (67.67%), H (4.65%), N (7.17%), O (12.29%), S (8.21%) |
| Atom Count | 46 |
| PI | 3.85 |
| Smiles | c1(cc(c(c(c1)OC)O)CSc1ccc2c(c1)cccc2)/C=C(C#N)/C(=O)N |
| InChI | 1S/C22H18N2O3S/c1-27-20-10-14(8-17(12-23)22(24)26)9-18(21(20)25)13-28-19-7-6-15-4-2-3-5-16(15)11-19/
h2-11,25H,13H2,1H3,(H2,24,26)/b17-8+ |
| InChIKey | PWAFUGMDLMAVBQ-CAOOACKPSA-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 |
| 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 |
44345649
|
| Drug Bank Link | - |
| ChemSpider Link | 23201852 |
| ChEMBL Link | CHEMBL330879 |
