General Property |
Molceule ID (DB) | EGIN0003804 |
Inhibitor Class | Indolinone |
Molecule Name in Refrence Article | 11f compound |
IUPAC Name | 3-(5-{[(3Z)-6-(3-methoxyphenyl)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoic acid |
Formula | C24H22N2O4 |
Mass | 402.4425 |
Exact Mass | 402.1579572 |
Composition | C (71.63%), H (5.51%), N (6.96%), O (15.9%) |
Atom Count | 52 |
PI | 1 |
Smiles | C1(=C/c2[nH]cc(c2C)CCC(=O)O)/C(=O)Nc2c1ccc(c2)c1cc(OC)ccc1 |
InChI | 1S/C24H22N2O4/c1-14-17(7-9-23(27)28)13-25-21(14)12-20-19-8-6-16(11-22(19)26-24(20)29)15-4-3-5-18(10-
15)30-2/h3-6,8,10-13,25H,7,9H2,1-2H3,(H,26,29)(H,27,28)/b20-12- |
InChIKey | YAHVZVQVATYZMK-NDENLUEZSA-N |
2D Structure | ![](./image/EGIN0003804.png) | Structure Backbone | ![](./frame/f_EGIN0003804.png) |
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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 | 10602697 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | PDGFR beta | FGFR1 | VEGFR2 | ALL |
Pub Chem Link |
5329143
|
Drug Bank Link | - |
ChemSpider Link | 4486305 |
ChEMBL Link | CHEMBL148514 |