| General Property |
| Molceule ID (DB) | EGIN0002769 |
| Inhibitor Class | Dithiobis-indole |
| Molecule Name in Refrence Article | 7v compound |
| IUPAC Name | 1-{2-[(3-acetyl-1-methyl-1H-indol-2-yl)disulfanyl]-1-methyl-1H-indol-3-yl}ethan-1-one |
| Formula | C22H20N2O2S2 |
| Mass | 408.536 |
| Exact Mass | 408.0966193 |
| Composition | C (64.68%), H (4.93%), N (6.86%), O (7.83%), S (15.7%) |
| Atom Count | 48 |
| PI | No isoelectric point. |
| Smiles | c1(c(c2c(n1C)cccc2)C(=O)C)SSc1c(c2c(n1C)cccc2)C(=O)C |
| InChI | 1S/C22H20N2O2S2/c1-13(25)19-15-9-5-7-11-17(15)23(3)21(19)27-28-22-20(14(2)26)16-10-6-8-12-18(16)24(2
2)4/h5-12H,1-4H3 |
| InChIKey | TTWGTAOWALLDCB-UHFFFAOYSA-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 | 7837241 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | SRC | |
| Pub Chem Link |
10409198
|
| Drug Bank Link | - |
| ChemSpider Link | 8584635 |
| ChEMBL Link | CHEMBL351920 |
