General Property |
Molceule ID (DB) | EGIN0002639 |
Inhibitor Class | Amino-salicylate |
Molecule Name in Refrence Article | 12 compound |
IUPAC Name | 5-[(E)-2-(2,5-dihydroxyphenyl)ethenyl]-2-hydroxybenzoic acid |
Formula | C15H12O5 |
Mass | 272.2528 |
Exact Mass | 272.0684735 |
Composition | C (66.17%), H (4.44%), O (29.38%) |
Atom Count | 32 |
PI | No isoelectric point. |
Smiles | c1(C(=O)O)c(ccc(c1)/C=C/c1c(ccc(c1)O)O)O |
InChI | 1S/C15H12O5/c16-11-4-6-13(17)10(8-11)3-1-9-2-5-14(18)12(7-9)15(19)20/h1-8,16-18H,(H,19,20)/b3-1+ |
InChIKey | AYPFKZQQTSLEJG-HNQUOIGGSA-N |
2D Structure | ![](./image/EGIN0002639.png) | Structure Backbone | ![](./frame/f_EGIN0002639.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 | 8105084 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | p56lck | |
Pub Chem Link |
5353259
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Drug Bank Link | - |
ChemSpider Link | 4510029 |
ChEMBL Link | CHEMBL102362 |