| General Property |
| Molceule ID (DB) | EGIN0002861 |
| Inhibitor Class | Dithiobis-indole |
| Molecule Name in Refrence Article | 9g compound |
| IUPAC Name | (3S)-5-chloro-1-methyl-N-phenyl-2-sulfanylidene-2,3-dihydro-1H-indole-3-carboxamide |
| Formula | C16H13ClN2OS |
| Mass | 316.805 |
| Exact Mass | 316.0437114 |
| Composition | C (60.66%), H (4.14%), Cl (11.19%), N (8.84%), O (5.05%), S (10.12%) |
| Atom Count | 34 |
| PI | 0.85 |
| Smiles | C1(=S)[C@@H](c2c(N1C)ccc(c2)Cl)C(=O)Nc1ccccc1 |
| InChI | 1S/C16H13ClN2OS/c1-19-13-8-7-10(17)9-12(13)14(16(19)21)15(20)18-11-5-3-2-4-6-11/h2-9,14H,1H3,(H,18,2
0)/t14-/m0/s1 |
| InChIKey | LKNJAWRXHXSFKQ-AWEZNQCLSA-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 | 8027985 |
| 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 | 4485783 |
| ChEMBL Link | CHEMBL62067 |
