| General Property |
| Molceule ID (DB) | EGIN0002894 |
| Inhibitor Class | Amino-salicylate |
| Molecule Name in Refrence Article | II7 compound |
| IUPAC Name | [(5-{[(2,5-dihydroxyphenyl)methyl]amino}-2-hydroxyphenyl)methyl]phosphonic acid |
| Formula | C14H16NO6P |
| Mass | 325.2537 |
| Exact Mass | 325.0715238 |
| Composition | C (51.7%), H (4.96%), N (4.31%), O (29.51%), P (9.52%) |
| Atom Count | 38 |
| PI | 3.42 |
| Smiles | P(=O)(Cc1c(ccc(c1)NCc1c(ccc(c1)O)O)O)(O)O |
| InChI | 1S/C14H16NO6P/c16-12-2-4-13(17)9(6-12)7-15-11-1-3-14(18)10(5-11)8-22(19,20)21/h1-6,15-18H,7-8H2,(H2,
19,20,21) |
| InChIKey | VMTDRVHYULWNHX-UHFFFAOYSA-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 |
10041970
|
| Drug Bank Link | - |
| ChemSpider Link | 8217534 |
| ChEMBL Link | CHEMBL352876 |
