| General Property |
| Molceule ID (DB) | EGIN0004622 |
| Inhibitor Class | Diphenyl-amine |
| Molecule Name in Refrence Article | 13c |
| IUPAC Name | N-(4,5-dioxo-3-phenyl-2-sulfanylideneimidazolidin-1-yl)-4-({2-[(4,5-dioxo-3-phenyl-2-sulfanylideneimidazolidin-1-yl)carbamoyl]phenyl}amino)benzamide |
| Formula | C32H21N7O6S2 |
| Mass | 663.682 |
| Exact Mass | 663.0994728 |
| Composition | C (57.91%), H (3.19%), N (14.77%), O (14.46%), S (9.66%) |
| Atom Count | 68 |
| PI | 5.59 |
| Smiles | c1cc(ccc1Nc1c(cccc1)C(=O)NN1C(=S)N(C(=O)C1=O)c1ccccc1)C(=O)NN1C(=O)C(=O)N(C1=S)c1ccccc1 |
| InChI | 1S/C32H21N7O6S2/c40-25(34-38-29(44)27(42)36(31(38)46)21-9-3-1-4-10-21)19-15-17-20(18-16-19)33-24-14-
8-7-13-23(24)26(41)35-39-30(45)28(43)37(32(39)47)22-11-5-2-6-12-22/h1-18,33H,(H,34,40)(H,35,41) |
| InChIKey | IQMYCEALCNCPTL-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 |
53497026
|
| Drug Bank Link | - |
| ChemSpider Link | - |
| ChEMBL Link | - |
