General Property |
Molceule ID (DB) | EGIN0002874 |
Inhibitor Class | Amino-salicylate |
Molecule Name in Refrence Article | I4 compound |
IUPAC Name | N-(tert-butoxy)-2-{5-[(E)-[(2,5-dihydroxyphenyl)methylidene]amino]-2-hydroxyphenyl}acetamide |
Formula | C19H22N2O5 |
Mass | 358.3884 |
Exact Mass | 358.1528718 |
Composition | C (63.67%), H (6.19%), N (7.82%), O (22.32%) |
Atom Count | 48 |
PI | 4.96 |
Smiles | c1(/C=N/c2cc(CC(=O)NOC(C)(C)C)c(cc2)O)c(ccc(c1)O)O |
InChI | 1S/C19H22N2O5/c1-19(2,3)26-21-18(25)10-12-8-14(4-6-16(12)23)20-11-13-9-15(22)5-7-17(13)24/h4-9,11,22
-24H,10H2,1-3H3,(H,21,25)/b20-11+ |
InChIKey | LCVKKKFECGWBDT-RGVLZGJSSA-N |
2D Structure | ![](./image/EGIN0002874.png) | Structure Backbone | ![](./frame/f_EGIN0002874.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 | 8145236 |
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 |
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Drug Bank Link | - |
ChemSpider Link | 23239086 |
ChEMBL Link | CHEMBL422899 |