| General Property |
| Molceule ID (DB) | EGIN0002666 |
| Inhibitor Class | Dithiobis-indole |
| Molecule Name in Refrence Article | 11a compound |
| IUPAC Name | N-benzyl-2-[(3R)-2-sulfanylidene-2,3-dihydro-1H-indol-3-yl]acetamide |
| Formula | C17H16N2OS |
| Mass | 296.387 |
| Exact Mass | 296.0983338 |
| Composition | C (68.89%), H (5.44%), N (9.45%), O (5.4%), S (10.82%) |
| Atom Count | 37 |
| PI | 3.46 |
| Smiles | c1cccc2c1[C@H](C(=S)N2)CC(=O)NCc1ccccc1 |
| InChI | 1S/C17H16N2OS/c20-16(18-11-12-6-2-1-3-7-12)10-14-13-8-4-5-9-15(13)19-17(14)21/h1-9,14H,10-11H2,(H,18
,20)(H,19,21)/t14-/m1/s1 |
| InChIKey | AZIKYQWSIXOHGI-CQSZACIVSA-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 | 7510340 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | SRC | |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 4485753 |
| ChEMBL Link | CHEMBL155389 |
