General Property |
Molceule ID (DB) | EGIN0003885 |
Inhibitor Class | Indolinone |
Molecule Name in Refrence Article | 4c compound |
IUPAC Name | (3Z)-2-oxo-3-(4,5,6,7-tetrahydro-1H-indol-2-ylmethylidene)-2,3-dihydro-1H-indole-5-sulfonamide |
Formula | C17H17N3O3S |
Mass | 343.4 |
Exact Mass | 343.0990621 |
Composition | C (59.46%), H (4.99%), N (12.24%), O (13.98%), S (9.34%) |
Atom Count | 41 |
PI | 3.95 |
Smiles | S(=O)(=O)(c1cc2/C(=C/c3[nH]c4c(c3)CCCC4)/C(=O)Nc2cc1)N |
InChI | 1S/C17H17N3O3S/c18-24(22,23)12-5-6-16-13(9-12)14(17(21)20-16)8-11-7-10-3-1-2-4-15(10)19-11/h5-9,19H,
1-4H2,(H,20,21)(H2,18,22,23)/b14-8- |
InChIKey | FHSRUXRMSRJDQV-ZSOIEALJSA-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 | 10893303 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | PDGFR beta | FGFR1 | VEGFR2 | p60c-Src | ALL |
Pub Chem Link |
5329156
|
Drug Bank Link | DB08039 |
ChemSpider Link | 4486318 |
ChEMBL Link | CHEMBL88483 |