General Property |
Molceule ID (DB) | EGIN0001265 |
Inhibitor Class | Chrysin |
Molecule Name in Refrence Article | 14 compound |
IUPAC Name | N-heptyl-2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetamide |
Formula | C24H27NO5 |
Mass | 409.4749 |
Exact Mass | 409.188923 |
Composition | C (70.4%), H (6.65%), N (3.42%), O (19.54%) |
Atom Count | 57 |
PI | 1.82 |
Smiles | c12c(c(cc(c1)OCC(=O)NCCCCCCC)O)c(=O)cc(o2)c1ccccc1 |
InChI | 1S/C24H27NO5/c1-2-3-4-5-9-12-25-23(28)16-29-18-13-19(26)24-20(27)15-21(30-22(24)14-18)17-10-7-6-8-11
-17/h6-8,10-11,13-15,26H,2-5,9,12,16H2,1H3,(H,25,28) |
InChIKey | UBHZWOZWFUBYMX-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0001265.png) | Structure Backbone | ![](./frame/f_EGIN0001265.png) |
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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 | 20056425 |
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 |
46231745
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Drug Bank Link | - |
ChemSpider Link | 24647519 |
ChEMBL Link | CHEMBL597303 |