General Property |
Molceule ID (DB) | EGIN0003805 |
Inhibitor Class | Indolinone |
Molecule Name in Refrence Article | 11g compound |
IUPAC Name | 3-(5-{[(3Z)-6-(2-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)c1c(OC)cccc1 |
InChI | 1S/C24H22N2O4/c1-14-16(8-10-23(27)28)13-25-20(14)12-19-18-9-7-15(11-21(18)26-24(19)29)17-5-3-4-6-22(
17)30-2/h3-7,9,11-13,25H,8,10H2,1-2H3,(H,26,29)(H,27,28)/b19-12- |
InChIKey | IZKQKZYHPAYOKJ-UNOMPAQXSA-N |
2D Structure | | Structure Backbone | |
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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 | VEGFR2 | FGFR1 | ALL |
Pub Chem Link |
5329144
|
Drug Bank Link | - |
ChemSpider Link | 4486306 |
ChEMBL Link | CHEMBL147112 |