General Property |
Molceule ID (DB) | EGIN0001270 |
Inhibitor Class | Chrysin |
Molecule Name in Refrence Article | 19 compound |
IUPAC Name | 2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]-N-tetradecylacetamide |
Formula | C31H41NO5 |
Mass | 507.6609 |
Exact Mass | 507.2984734 |
Composition | C (73.34%), H (8.14%), N (2.76%), O (15.76%) |
Atom Count | 78 |
PI | 1.82 |
Smiles | c12c(c(cc(c1)OCC(=O)NCCCCCCCCCCCCCC)O)c(=O)cc(o2)c1ccccc1 |
InChI | 1S/C31H41NO5/c1-2-3-4-5-6-7-8-9-10-11-12-16-19-32-30(35)23-36-25-20-26(33)31-27(34)22-28(37-29(31)21
-25)24-17-14-13-15-18-24/h13-15,17-18,20-22,33H,2-12,16,19,23H2,1H3,(H,32,35) |
InChIKey | OEJNEVMDTBUXDF-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0001270.png) | Structure Backbone | ![](./frame/f_EGIN0001270.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 |
46231820
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Drug Bank Link | - |
ChemSpider Link | 24649613 |
ChEMBL Link | CHEMBL598520 |