General Property |
Molceule ID (DB) | EGIN0003891 |
Inhibitor Class | Indolinone |
Molecule Name in Refrence Article | 4i compound |
IUPAC Name | (3Z)-6-(4-methoxyphenyl)-3-(4,5,6,7-tetrahydro-1H-indol-2-ylmethylidene)-2,3-dihydro-1H-indol-2-one |
Formula | C24H22N2O2 |
Mass | 370.4437 |
Exact Mass | 370.168128 |
Composition | C (77.81%), H (5.99%), N (7.56%), O (8.64%) |
Atom Count | 50 |
PI | 4.55 |
Smiles | C1(=C/c2[nH]c3c(c2)CCCC3)/C(=O)Nc2c1ccc(c2)c1ccc(cc1)OC |
InChI | 1S/C24H22N2O2/c1-28-19-9-6-15(7-10-19)16-8-11-20-21(24(27)26-23(20)13-16)14-18-12-17-4-2-3-5-22(17)2
5-18/h6-14,25H,2-5H2,1H3,(H,26,27)/b21-14- |
InChIKey | DPKWEIZIBQDTFF-STZFKDTASA-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 | FGFR1 | p60c-Src | VEGFR2 | PDGFR beta | ALL |
Pub Chem Link |
5329162
|
Drug Bank Link | - |
ChemSpider Link | 4486324 |
ChEMBL Link | CHEMBL313500 |