| General Property |
| Molceule ID (DB) | EGIN0002962 |
| Inhibitor Class | Thioxo-indole |
| Molecule Name in Refrence Article | 6 compound |
| IUPAC Name | 2-[(3R)-1-methyl-2-sulfanylidene-2,3-dihydro-1H-indol-3-yl]acetic acid |
| Formula | C11H11NO2S |
| Mass | 221.276 |
| Exact Mass | 221.0510493 |
| Composition | C (59.71%), H (5.01%), N (6.33%), O (14.46%), S (14.49%) |
| Atom Count | 26 |
| PI | 0.74 |
| Smiles | C1(=S)N(c2c([C@H]1CC(=O)O)cccc2)C |
| InChI | 1S/C11H11NO2S/c1-12-9-5-3-2-4-7(9)8(11(12)15)6-10(13)14/h2-5,8H,6H2,1H3,(H,13,14)/t8-/m1/s1 |
| InChIKey | MGQMNRPORBTSDW-MRVPVSSYSA-N |
| 2D Structure |  | Structure Backbone |  |
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| 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 |
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| Drug Bank Link | - |
| ChemSpider Link | 4485700 |
| ChEMBL Link | CHEMBL314416 |
