| General Property |
| Molceule ID (DB) | EGIN0002836 |
| Inhibitor Class | Dithiobis-indole |
| Molecule Name in Refrence Article | 10c compound |
| IUPAC Name | 2-{[1,4-dimethyl-3-(phenylcarbamoyl)-1H-indol-2-yl]disulfanyl}-1,4-dimethyl-N-phenyl-1H-indole-3-carboxamide |
| Formula | C34H30N4O2S2 |
| Mass | 590.758 |
| Exact Mass | 590.1810176 |
| Composition | C (69.13%), H (5.12%), N (9.48%), O (5.42%), S (10.86%) |
| Atom Count | 72 |
| PI | 3.74 |
| Smiles | Cn1c(SSc2c(C(=O)Nc3ccccc3)c3c(cccc3n2C)C)c(C(=O)Nc2ccccc2)c2c(cccc12)C |
| InChI | 1S/C34H30N4O2S2/c1-21-13-11-19-25-27(21)29(31(39)35-23-15-7-5-8-16-23)33(37(25)3)41-42-34-30(32(40)3
6-24-17-9-6-10-18-24)28-22(2)14-12-20-26(28)38(34)4/h5-20H,1-4H3,(H,35,39)(H,36,40) |
| InChIKey | LDDNNZKKMXSXPS-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 |
5328594
|
| Drug Bank Link | - |
| ChemSpider Link | 4485758 |
| ChEMBL Link | CHEMBL292287 |
