| General Property |
| Molceule ID (DB) | EGIN0002961 |
| Inhibitor Class | Thioxo-indole |
| Molecule Name in Refrence Article | 5 compound |
| IUPAC Name | 2-[(3R)-2-sulfanylidene-2,3-dihydro-1H-indol-3-yl]acetic acid |
| Formula | C10H9NO2S |
| Mass | 207.249 |
| Exact Mass | 207.0353992 |
| Composition | C (57.95%), H (4.38%), N (6.76%), O (15.44%), S (15.47%) |
| Atom Count | 23 |
| PI | 0.71 |
| Smiles | c1cccc2c1[C@H](C(=S)N2)CC(=O)O |
| InChI | 1S/C10H9NO2S/c12-9(13)5-7-6-3-1-2-4-8(6)11-10(7)14/h1-4,7H,5H2,(H,11,14)(H,12,13)/t7-/m1/s1 |
| InChIKey | KTIODNZPIYCZSR-SSDOTTSWSA-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 | 8355247 |
| 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 |
21762817
|
| Drug Bank Link | - |
| ChemSpider Link | 4485699 |
| ChEMBL Link | CHEMBL83429 |
