| General Property |
| Molceule ID (DB) | EGIN0004847 |
| Inhibitor Class | Indole |
| Molecule Name in Refrence Article | 5 |
| IUPAC Name | (2E)-2-[(E)-(3,4-dihydroxyphenyl)carbonyl]-3-(1H-indol-3-yl)prop-2-enenitrile |
| Formula | C18H12N2O3 |
| Mass | 304.2995 |
| Exact Mass | 304.0847923 |
| Composition | C (71.05%), H (3.97%), N (9.21%), O (15.77%) |
| Atom Count | 35 |
| PI | No isoelectric point. |
| Smiles | c1cccc2c1c(c[nH]2)/C=C(/C(=O)c1cc(c(cc1)O)O)C#N |
| InChI | 1S/C18H12N2O3/c19-9-12(18(23)11-5-6-16(21)17(22)8-11)7-13-10-20-15-4-2-1-3-14(13)15/h1-8,10,20-22H/b
12-7+ |
| InChIKey | TTZDOBVWBQXGDC-KPKJPENVSA-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 | 8667360 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | PDGFR | |
| Pub Chem Link |
5329275
|
| Drug Bank Link | - |
| ChemSpider Link | 4486426 |
| ChEMBL Link | CHEMBL68534 |
