| General Property |
| Molceule ID (DB) | EGIN0003281 |
| Inhibitor Class | Indolone |
| Molecule Name in Refrence Article | SU-11652 |
| IUPAC Name | 5-{[(3Z)-5-chloro-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-N-[2-(diethylamino)ethyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide |
| Formula | C22H27ClN4O2 |
| Mass | 414.928 |
| Exact Mass | 414.1822538 |
| Composition | C (63.68%), H (6.56%), Cl (8.54%), N (13.5%), O (7.71%) |
| Atom Count | 56 |
| PI | 10.15 |
| Smiles | CCN(CC)CCNC(=O)c1c(C)c([nH]c1C)/C=C1/c2cc(Cl)ccc2NC1=O |
| InChI | 1S/C22H27ClN4O2/c1-5-27(6-2)10-9-24-22(29)20-13(3)19(25-14(20)4)12-17-16-11-15(23)7-8-18(16)26-21(17
)28/h7-8,11-12,25H,5-6,9-10H2,1-4H3,(H,24,29)(H,26,28)/b17-12- |
| InChIKey | XPLJEFSRINKZLC-ATVHPVEESA-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 | 12646019 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | FGFR1 | VEGFR2 | PDGFR beta | ALL |
| Pub Chem Link |
5329103
|
| Drug Bank Link | - |
| ChemSpider Link | 4486265 |
| ChEMBL Link | CHEMBL13485 |
