General Property |
Molceule ID (DB) | EGIN0003803 |
Inhibitor Class | Indolinone |
Molecule Name in Refrence Article | 11e compound |
IUPAC Name | 3-(4-methyl-5-{[(3Z)-2-oxo-6-phenyl-2,3-dihydro-1H-indol-3-ylidene]methyl}-1H-pyrrol-3-yl)propanoic acid |
Formula | C23H20N2O3 |
Mass | 372.4165 |
Exact Mass | 372.1473925 |
Composition | C (74.18%), H (5.41%), N (7.52%), O (12.89%) |
Atom Count | 48 |
PI | 1 |
Smiles | C1(=Cc2[nH]cc(c2C)CCC(=O)O)/C(=O)Nc2c1ccc(c2)c1ccccc1 |
InChI | 1S/C23H20N2O3/c1-14-17(8-10-22(26)27)13-24-20(14)12-19-18-9-7-16(11-21(18)25-23(19)28)15-5-3-2-4-6-1
5/h2-7,9,11-13,24H,8,10H2,1H3,(H,25,28)(H,26,27)/b19-12- |
InChIKey | CEFJMJRPRONXNH-UNOMPAQXSA-N |
2D Structure | ![](./image/EGIN0003803.png) | Structure Backbone | ![](./frame/f_EGIN0003803.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 | FGFR1 | PDGFR beta | VEGFR2 | ALL |
Pub Chem Link |
5329142
|
Drug Bank Link | - |
ChemSpider Link | 4486304 21202100 |
ChEMBL Link | CHEMBL347074 |