General Property |
Molceule ID (DB) | EGIN0001247 |
Inhibitor Class | Tyrphostin |
Molecule Name in Refrence Article | 60 compound |
IUPAC Name | (2E)-2-cyano-N-cyclohexyl-3-(3,4-dihydroxyphenyl)prop-2-enamide |
Formula | C16H18N2O3 |
Mass | 286.3257 |
Exact Mass | 286.1317425 |
Composition | C (67.12%), H (6.34%), N (9.78%), O (16.76%) |
Atom Count | 39 |
PI | 4.33 |
Smiles | c1(ccc(c(c1)O)O)/C=C(/C(=O)NC1CCCCC1)C#N |
InChI | 1S/C16H18N2O3/c17-10-12(8-11-6-7-14(19)15(20)9-11)16(21)18-13-4-2-1-3-5-13/h6-9,13,19-20H,1-5H2,(H,1
8,21)/b12-8+ |
InChIKey | XMFXBOGXTNAKKW-XYOKQWHBSA-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 | 1676428 | 8098709 | |
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 |
2385464
|
Drug Bank Link | - |
ChemSpider Link | 1781949 |
ChEMBL Link | CHEMBL417941 |