| General Property |
| Molceule ID (DB) | EGIN0003894 |
| Inhibitor Class | Indolinone |
| Molecule Name in Refrence Article | 9b compound |
| IUPAC Name | 3-(2-{[(3Z)-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-4,5,6,7-tetrahydro-1H-indol-3-yl)propanoic acid |
| Formula | C20H19BrN2O3 |
| Mass | 415.28 |
| Exact Mass | 414.0579051 |
| Composition | C (57.84%), H (4.61%), Br (19.24%), N (6.75%), O (11.56%) |
| Atom Count | 45 |
| PI | 1.03 |
| Smiles | c1(c(c2c([nH]1)CCCC2)CCC(=O)O)/C=C/1C(=O)Nc2c1cc(cc2)Br |
| InChI | 1S/C20H19BrN2O3/c21-11-5-7-17-14(9-11)15(20(26)23-17)10-18-13(6-8-19(24)25)12-3-1-2-4-16(12)22-18/h5
,7,9-10,22H,1-4,6,8H2,(H,23,26)(H,24,25)/b15-10- |
| InChIKey | OICXIBPVOXVRBW-GDNBJRDFSA-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 | 10893303 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | p60c-Src | FGFR1 | VEGFR2 | PDGFR beta | ALL |
| Pub Chem Link |
5329164
|
| Drug Bank Link | - |
| ChemSpider Link | 4486326 21201315 |
| ChEMBL Link | CHEMBL314995 |
