| General Property |
| Molceule ID (DB) | EGIN0002845 |
| Inhibitor Class | Dithiobis-indole |
| Molecule Name in Refrence Article | 10l compound |
| IUPAC Name | 5-hydroxy-2-{[5-hydroxy-1-methyl-3-(phenylcarbamoyl)-1H-indol-2-yl]disulfanyl}-1-methyl-N-phenyl-1H-indole-3-carboxamide |
| Formula | C32H26N4O4S2 |
| Mass | 594.703 |
| Exact Mass | 594.1395467 |
| Composition | C (64.63%), H (4.41%), N (9.42%), O (10.76%), S (10.78%) |
| Atom Count | 68 |
| PI | 2.68 |
| Smiles | Cn1c(SSc2c(C(=O)Nc3ccccc3)c3cc(ccc3n2C)O)c(C(=O)Nc2ccccc2)c2cc(ccc12)O |
| InChI | 1S/C32H26N4O4S2/c1-35-25-15-13-21(37)17-23(25)27(29(39)33-19-9-5-3-6-10-19)31(35)41-42-32-28(30(40)3
4-20-11-7-4-8-12-20)24-18-22(38)14-16-26(24)36(32)2/h3-18,37-38H,1-2H3,(H,33,39)(H,34,40) |
| InChIKey | IWMOCSLVFAOWEJ-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 | 8027985 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | SRC | |
| Pub Chem Link |
5328603
|
| Drug Bank Link | - |
| ChemSpider Link | 4485767 |
| ChEMBL Link | CHEMBL293250 |
