| General Property |
| Molceule ID (DB) | EGIN0002913 |
| Inhibitor Class | Amino-salicylate |
| Molecule Name in Refrence Article | II26 compound |
| IUPAC Name | 3-phenylpropyl 5-{[(2,5-dihydroxyphenyl)methyl]amino}-2-hydroxybenzoate |
| Formula | C23H23NO5 |
| Mass | 393.4324 |
| Exact Mass | 393.1576229 |
| Composition | C (70.21%), H (5.89%), N (3.56%), O (20.33%) |
| Atom Count | 52 |
| PI | 6.86 |
| Smiles | c1(C(=O)OCCCc2ccccc2)c(ccc(c1)NCc1c(ccc(c1)O)O)O |
| InChI | 1S/C23H23NO5/c25-19-9-11-21(26)17(13-19)15-24-18-8-10-22(27)20(14-18)23(28)29-12-4-7-16-5-2-1-3-6-16
/h1-3,5-6,8-11,13-14,24-27H,4,7,12,15H2 |
| InChIKey | WEZNDVHCINCVNY-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 |
9821918
|
| Drug Bank Link | - |
| ChemSpider Link | 7997667 |
| ChEMBL Link | CHEMBL168533 |
