| General Property |
| Molceule ID (DB) | EGIN0003452 |
| Inhibitor Class | Indolylmaleimide |
| Molecule Name in Refrence Article | 11 (Br-Maleimide) |
| IUPAC Name | 3-(5-bromo-1H-indol-3-yl)-4-(3,4,5-trimethoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione |
| Formula | C21H17BrN2O5 |
| Mass | 457.274 |
| Exact Mass | 456.0320843 |
| Composition | C (55.16%), H (3.75%), Br (17.47%), N (6.13%), O (17.49%) |
| Atom Count | 46 |
| PI | 2.56 |
| Smiles | c1(ccc2c(c1)c(c[nH]2)C1=C(C(=O)NC1=O)c1cc(c(c(c1)OC)OC)OC)Br |
| InChI | 1S/C21H17BrN2O5/c1-27-15-6-10(7-16(28-2)19(15)29-3)17-18(21(26)24-20(17)25)13-9-23-14-5-4-11(22)8-12
(13)14/h4-9,23H,1-3H3,(H,24,25,26) |
| InChIKey | AQXIMVWUURMKKC-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 | 20031417 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | IGF1R | KIT | PDGFR beta | PDGFR alpha | TIE2 | VEGFR1 | VEGFR2 | VEGFR3 | ALL |
| Pub Chem Link |
46231221
|
| Drug Bank Link | - |
| ChemSpider Link | 24653857 |
| ChEMBL Link | CHEMBL605957 |
