General Property |
Molceule ID (DB) | EGIN0002901 |
Inhibitor Class | Amino-salicylate |
Molecule Name in Refrence Article | II14 compound |
IUPAC Name | ethyl 5-{[(2,5-dihydroxyphenyl)methyl]amino}-2-hydroxybenzoate |
Formula | C16H17NO5 |
Mass | 303.3099 |
Exact Mass | 303.1106727 |
Composition | C (63.36%), H (5.65%), N (4.62%), O (26.37%) |
Atom Count | 39 |
PI | 6.86 |
Smiles | c1(C(=O)OCC)c(ccc(c1)NCc1c(ccc(c1)O)O)O |
InChI | 1S/C16H17NO5/c1-2-22-16(21)13-8-11(3-5-15(13)20)17-9-10-7-12(18)4-6-14(10)19/h3-8,17-20H,2,9H2,1H3 |
InChIKey | DAXUVEJLUCSOEI-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0002901.png) | Structure Backbone | ![](./frame/f_EGIN0002901.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 | 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 |
10357604
|
Drug Bank Link | - |
ChemSpider Link | 8533053 |
ChEMBL Link | CHEMBL355857 |