| General Property |
| Molceule ID (DB) | EGIN0004865 |
| Inhibitor Class | Indole |
| Molecule Name in Refrence Article | 3 |
| IUPAC Name | (2Z)-2-cyano-3-(1H-indol-5-yl)-N-[(1R)-1-phenylethyl]prop-2-enamide |
| Formula | C20H17N3O |
| Mass | 315.3685 |
| Exact Mass | 315.1371622 |
| Composition | C (76.17%), H (5.43%), N (13.32%), O (5.07%) |
| Atom Count | 41 |
| PI | 4.08 |
| Smiles | c1c2c(ccc1/C=C(/C#N)C(=O)N[C@H](C)c1ccccc1)[nH]cc2 |
| InChI | 1S/C20H17N3O/c1-14(16-5-3-2-4-6-16)23-20(24)18(13-21)12-15-7-8-19-17(11-15)9-10-22-19/h2-12,14,22H,1
H3,(H,23,24)/b18-12-/t14-/m1/s1 |
| InChIKey | YAKSTXXJGSXXCJ-IIMQCXAKSA-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 |
-
|
| Drug Bank Link | - |
| ChemSpider Link | 4486424 331719 20120327 |
| ChEMBL Link | - |
