General Property |
Molceule ID (DB) | EGIN0002594 |
Inhibitor Class | Amino-salicylate |
Molecule Name in Refrence Article | 2 compound |
IUPAC Name | 5-{[(2,5-dihydroxyphenyl)methyl]amino}-2-hydroxybenzoic acid |
Formula | C14H13NO5 |
Mass | 275.2567 |
Exact Mass | 275.0793725 |
Composition | C (61.09%), H (4.76%), N (5.09%), O (29.06%) |
Atom Count | 33 |
PI | 4.13 |
Smiles | c1cc(cc(c1O)C(=O)O)NCc1c(ccc(c1)O)O |
InChI | 1S/C14H13NO5/c16-10-2-4-12(17)8(5-10)7-15-9-1-3-13(18)11(6-9)14(19)20/h1-6,15-18H,7H2,(H,19,20) |
InChIKey | LULATDWLDJOKCX-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0002594.png) | Structure Backbone | ![](./frame/f_EGIN0002594.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 | 7990108 | 8105084 | 8145236 | 8258833 | |
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 |
3896
|
Drug Bank Link | - |
ChemSpider Link | 3759 |
ChEMBL Link | CHEMBL319620 |