| General Property |
| Molceule ID (DB) | EGIN0002876 |
| Inhibitor Class | Amino-salicylate |
| Molecule Name in Refrence Article | I6 compound |
| IUPAC Name | diethyl ({5-[(E)-[(2,5-dihydroxyphenyl)methylidene]amino]-2-hydroxyphenyl}methyl)phosphonate |
| Formula | C18H22NO6P |
| Mass | 379.3441 |
| Exact Mass | 379.118474 |
| Composition | C (56.99%), H (5.85%), N (3.69%), O (25.31%), P (8.17%) |
| Atom Count | 48 |
| PI | 5.2 |
| Smiles | P(=O)(Cc1c(ccc(/N=C/c2c(ccc(c2)O)O)c1)O)(OCC)OCC |
| InChI | 1S/C18H22NO6P/c1-3-24-26(23,25-4-2)12-14-9-15(5-7-18(14)22)19-11-13-10-16(20)6-8-17(13)21/h5-11,20-2
2H,3-4,12H2,1-2H3/b19-11+ |
| InChIKey | JEFOBQNISJYHFT-YBFXNURJSA-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 | 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 | 23239396 |
| ChEMBL Link | CHEMBL354757 |
