General Property |
Molceule ID (DB) | EGIN0002715 |
Inhibitor Class | Acrylo-phenone |
Molecule Name in Refrence Article | 1 compound |
IUPAC Name | 2-[(dimethylamino)methyl]-1-phenylprop-2-en-1-one |
Formula | C12H15NO |
Mass | 189.2536 |
Exact Mass | 189.1153641 |
Composition | C (76.16%), H (7.99%), N (7.4%), O (8.45%) |
Atom Count | 29 |
PI | No isoelectric point. |
Smiles | c1ccccc1C(=O)C(=C)CN(C)C |
InChI | 1S/C12H15NO/c1-10(9-13(2)3)12(14)11-7-5-4-6-8-11/h4-8H,1,9H2,2-3H3 |
InChIKey | AWGQYDRZMTZRRG-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 |
341040
|
Drug Bank Link | - |
ChemSpider Link | 302223 |
ChEMBL Link | CHEMBL1186542 |