General Property |
Molceule ID (DB) | EGIN0003884 |
Inhibitor Class | Indolinone |
Molecule Name in Refrence Article | 4b compound |
IUPAC Name | (3Z)-5-bromo-3-(4,5,6,7-tetrahydro-1H-indol-2-ylmethylidene)-2,3-dihydro-1H-indol-2-one |
Formula | C17H15BrN2O |
Mass | 343.218 |
Exact Mass | 342.0367758 |
Composition | C (59.49%), H (4.41%), Br (23.28%), N (8.16%), O (4.66%) |
Atom Count | 36 |
PI | 4.58 |
Smiles | C1(=C/c2[nH]c3c(c2)CCCC3)/C(=O)Nc2c1cc(cc2)Br |
InChI | 1S/C17H15BrN2O/c18-11-5-6-16-13(8-11)14(17(21)20-16)9-12-7-10-3-1-2-4-15(10)19-12/h5-9,19H,1-4H2,(H,
20,21)/b14-9- |
InChIKey | RFHPWPWVGFSLOP-ZROIWOOFSA-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 |
5329155
|
Drug Bank Link | - |
ChemSpider Link | 4486317 |
ChEMBL Link | CHEMBL88606 |