General Property |
Molceule ID (DB) | EGIN0002819 |
Inhibitor Class | Cinnamide |
Molecule Name in Refrence Article | 1 |
IUPAC Name | (2E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-phenylprop-2-enamide |
Formula | C16H12N2O3 |
Mass | 280.2781 |
Exact Mass | 280.0847923 |
Composition | C (68.56%), H (4.32%), N (9.99%), O (17.13%) |
Atom Count | 33 |
PI | 2.71 |
Smiles | N(C(=O)/C(=C/c1cc(c(cc1)O)O)/C#N)c1ccccc1 |
InChI | 1S/C16H12N2O3/c17-10-12(8-11-6-7-14(19)15(20)9-11)16(21)18-13-4-2-1-3-5-13/h1-9,19-20H,(H,18,21)/b12
-8+ |
InChIKey | HKHOVJYOELRGMV-XYOKQWHBSA-N |
2D Structure | ![](./image/EGIN0002819.png) | Structure Backbone | ![](./frame/f_EGIN0002819.png) |
|
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 | 8667360 | 1676428 | 10464027 | |
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 |
5328771
|
Drug Bank Link | - |
ChemSpider Link | 4485933 |
ChEMBL Link | CHEMBL56731 |