| General Property |
| Molceule ID (DB) | EGIN0004624 |
| Inhibitor Class | Diphenyl-amine |
| Molecule Name in Refrence Article | 13a |
| IUPAC Name | N-(3-ethyl-4,5-dioxo-2-sulfanylideneimidazolidin-1-yl)-4-({2-[(3-ethyl-4,5-dioxo-2-sulfanylideneimidazolidin-1-yl)carbamoyl]phenyl}amino)benzamide |
| Formula | C24H21N7O6S2 |
| Mass | 567.597 |
| Exact Mass | 567.0994728 |
| Composition | C (50.79%), H (3.73%), N (17.27%), O (16.91%), S (11.3%) |
| Atom Count | 60 |
| PI | 5.6 |
| Smiles | c1cc(ccc1Nc1c(cccc1)C(=O)NN1C(=S)N(C(=O)C1=O)CC)C(=O)NN1C(=O)C(=O)N(C1=S)CC |
| InChI | 1S/C24H21N7O6S2/c1-3-28-19(34)21(36)30(23(28)38)26-17(32)13-9-11-14(12-10-13)25-16-8-6-5-7-15(16)18(
33)27-31-22(37)20(35)29(4-2)24(31)39/h5-12,25H,3-4H2,1-2H3,(H,26,32)(H,27,33) |
| InChIKey | LYAZCVIQFXKHPO-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 | 21881256 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | No activity data against other kinases present in database |
| Pub Chem Link |
53497025
|
| Drug Bank Link | - |
| ChemSpider Link | - |
| ChEMBL Link | - |
