| General Property |
| Molceule ID (DB) | EGIN0003548 |
| Inhibitor Class | Tyrphostin |
| Molecule Name in Refrence Article | 17 (AG573) |
| IUPAC Name | (2E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-N-{4-[(2E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamido]butyl}-2-cyanoprop-2-enamide |
| Formula | C26H24Br2N4O6 |
| Mass | 648.3 |
| Exact Mass | 646.0062598 |
| Composition | C (48.17%), H (3.73%), Br (24.65%), N (8.64%), O (14.81%) |
| Atom Count | 62 |
| PI | 3.53 |
| Smiles | C(=Cc1cc(c(c(c1)OC)O)Br)(/C(=O)NCCCCNC(=O)/C(=C/c1cc(c(c(c1)OC)O)Br)/C#N)C#N |
| InChI | 1S/C26H24Br2N4O6/c1-37-21-11-15(9-19(27)23(21)33)7-17(13-29)25(35)31-5-3-4-6-32-26(36)18(14-30)8-16-
10-20(28)24(34)22(12-16)38-2/h7-12,33-34H,3-6H2,1-2H3,(H,31,35)(H,32,36)/b17-7+,18-8+ |
| InChIKey | MLVVVAQFZDHHMO-ZEELXFFVSA-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 | 9977015 |
| ChEMBL Link | CHEMBL357400 |
