| General Property |
| Molceule ID (DB) | EGIN0002770 |
| Inhibitor Class | Dithiobis-indole |
| Molecule Name in Refrence Article | 7w compound |
| IUPAC Name | 3-benzoyl-2-[(3-benzoyl-1-methyl-1H-indol-2-yl)disulfanyl]-1-methyl-1H-indole |
| Formula | C32H24N2O2S2 |
| Mass | 532.675 |
| Exact Mass | 532.1279194 |
| Composition | C (72.15%), H (4.54%), N (5.26%), O (6.01%), S (12.04%) |
| Atom Count | 62 |
| PI | No isoelectric point. |
| Smiles | c1(c(n(c2c1cccc2)C)SSc1c(c2c(n1C)cccc2)C(=O)c1ccccc1)C(=O)c1ccccc1 |
| InChI | 1S/C32H24N2O2S2/c1-33-25-19-11-9-17-23(25)27(29(35)21-13-5-3-6-14-21)31(33)37-38-32-28(30(36)22-15-7
-4-8-16-22)24-18-10-12-20-26(24)34(32)2/h3-20H,1-2H3 |
| InChIKey | AIADCOSLXNLQSJ-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 |
11756855
|
| Drug Bank Link | - |
| ChemSpider Link | 9931556 |
| ChEMBL Link | CHEMBL349322 |
