| General Property |
| Molceule ID (DB) | EGIN0005087 |
| Inhibitor Class | Curcumin |
| Molecule Name in Refrence Article | I16 |
| IUPAC Name | (2E,6E)â€2â€[(3,5â€dimethoxyphenyl)methylidene]â€6â€{[4â€(dimethylamino)phenyl]methylidene}cyclohexanâ€1â€one |
| Formula | C23H26O5 |
| Mass | 382.4495 |
| Exact Mass | 382.178023942 |
| Composition | C (72.23%), H (6.85%), O (20.92%) |
| Atom Count | 54 |
| PI | 2.85 |
| Smiles | [H]OC1=C([H])C(=C([H])C([H])=C1OC([H])([H])[H])C([H])([H])[C@]1([H])C(=O)C(=C(/[H])C2=C([H])C(OC([H])([H])[H])=C([H])C(OC([H])([H])[H])=C2[H])C([H])([H])C([H])([H])C1([H])[H] |
| InChI | 1S/C23H26O5/c1-26-19-11-16(12-20(14-19)27-2)10-18-6-4-5-17(23(18)25)9-15-7-8-22(28-3)21(24)13-15/h7-
8,10-14,17,24H,4-6,9H2,1-3H3/b18-10+/t17-/m1/s1 |
| InChIKey | UMPGVFAHYUEXNP-HJSBDDGSSA-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 | 23245570 |
| 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 | 28507199 |
| ChEMBL Link | CHEMBL2029438 |
