| General Property |
| Molceule ID (DB) | EGIN0001032 |
| Inhibitor Class | Indolinone |
| Molecule Name in Refrence Article | 1s compound |
| IUPAC Name | ethyl 3-(2-ethoxy-2-oxoethyl)-5-methyl-4-{[(3E)-2-oxo-5-[(piperidin-1-yl)sulfamoyl]-2,3-dihydro-1H-indol-3-ylidene]methyl}-1H-pyrrole-2-carboxylate |
| Formula | C26H32N4O7S |
| Mass | 544.62 |
| Exact Mass | 544.1991701 |
| Composition | C (57.34%), H (5.92%), N (10.29%), O (20.56%), S (5.89%) |
| Atom Count | 70 |
| PI | 4.86 |
| Smiles | c12c(ccc(c1)S(=O)(=O)NN1CCCCC1)NC(=O)/C/2=C/c1c(c([nH]c1C)C(=O)OCC)CC(=O)OCC |
| InChI | 1S/C26H32N4O7S/c1-4-36-23(31)15-20-18(16(3)27-24(20)26(33)37-5-2)14-21-19-13-17(9-10-22(19)28-25(21)
32)38(34,35)29-30-11-7-6-8-12-30/h9-10,13-14,27,29H,4-8,11-12,15H2,1-3H3,(H,28,32)/b21-14+ |
| InChIKey | NKHWODHCKVJKET-KGENOOAVSA-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 | 17184594 |
| 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 |
23264972
|
| Drug Bank Link | - |
| ChemSpider Link | - |
| ChEMBL Link | - |
