| General Property |
| Molceule ID (DB) | EGIN0002767 |
| Inhibitor Class | Dithiobis-indole |
| Molecule Name in Refrence Article | 7t compound |
| IUPAC Name | 1-methyl-2-({1-methyl-3-[(pyridin-4-yl)carbamoyl]-1H-indol-2-yl}disulfanyl)-N-(pyridin-4-yl)-1H-indole-3-carboxamide |
| Formula | C30H24N6O2S2 |
| Mass | 564.681 |
| Exact Mass | 564.1402154 |
| Composition | C (63.81%), H (4.28%), N (14.88%), O (5.67%), S (11.36%) |
| Atom Count | 64 |
| PI | 7.73 |
| Smiles | c1(c(C(=O)Nc2ccncc2)c2c(n1C)cccc2)SSc1c(C(=O)Nc2ccncc2)c2c(n1C)cccc2 |
| InChI | 1S/C30H24N6O2S2/c1-35-23-9-5-3-7-21(23)25(27(37)33-19-11-15-31-16-12-19)29(35)39-40-30-26(22-8-4-6-1
0-24(22)36(30)2)28(38)34-20-13-17-32-18-14-20/h3-18H,1-2H3,(H,31,33,37)(H,32,34,38) |
| InChIKey | GNJOCRJRIWUHFS-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 |
10053638
|
| Drug Bank Link | - |
| ChemSpider Link | 8229198 |
| ChEMBL Link | CHEMBL156281 |
