| General Property |
| Molceule ID (DB) | EGIN0003552 |
| Inhibitor Class | Tyrphostin |
| Molecule Name in Refrence Article | 21 (AG662) |
| IUPAC Name | (2E)-2-cyano-N-{3-[(2E)-2-cyano-3-(1H-indol-5-yl)prop-2-enamido]propyl}-3-(1H-indol-5-yl)prop-2-enamide |
| Formula | C27H22N6O2 |
| Mass | 462.5026 |
| Exact Mass | 462.180424 |
| Composition | C (70.12%), H (4.79%), N (18.17%), O (6.92%) |
| Atom Count | 57 |
| PI | 4.36 |
| Smiles | C(=Cc1cc2c([nH]cc2)cc1)(/C(=O)NCCCNC(=O)/C(=C/c1cc2c([nH]cc2)cc1)/C#N)C#N |
| InChI | 1S/C27H22N6O2/c28-16-22(14-18-2-4-24-20(12-18)6-10-30-24)26(34)32-8-1-9-33-27(35)23(17-29)15-19-3-5-
25-21(13-19)7-11-31-25/h2-7,10-15,30-31H,1,8-9H2,(H,32,34)(H,33,35)/b22-14+,23-15+ |
| InChIKey | OBKFTXZDEKYDTC-HOFJZWJUSA-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 | 8960549 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | No activity data against other kinases present in database |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 4486420 |
| ChEMBL Link | CHEMBL143108 |
