| General Property |
| Molceule ID (DB) | EGIN0002720 |
| Inhibitor Class | Acrylo-phenone |
| Molecule Name in Refrence Article | 6 compound |
| IUPAC Name | 1-[4-(benzyloxy)phenyl]-2-[(4-methylpiperazin-1-yl)methyl]prop-2-en-1-one |
| Formula | C22H26N2O2 |
| Mass | 350.454 |
| Exact Mass | 350.1994281 |
| Composition | C (75.4%), H (7.48%), N (7.99%), O (9.13%) |
| Atom Count | 52 |
| PI | No isoelectric point. |
| Smiles | CN1CCN(CC(=C)C(=O)c2ccc(OCc3ccccc3)cc2)CC1 |
| InChI | 1S/C22H26N2O2/c1-18(16-24-14-12-23(2)13-15-24)22(25)20-8-10-21(11-9-20)26-17-19-6-4-3-5-7-19/h3-11H,
1,12-17H2,2H3 |
| InChIKey | DKLODFNXUUJGRI-UHFFFAOYSA-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 | 7608909 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | c-Src | v-ab1 | PKC | ALL |
| Pub Chem Link |
10473096
|
| Drug Bank Link | - |
| ChemSpider Link | 8648507 |
| ChEMBL Link | CHEMBL1193175 |
