General Property |
Molceule ID (DB) | EGIN0002892 |
Inhibitor Class | Amino-salicylate |
Molecule Name in Refrence Article | II5 compound |
IUPAC Name | N-(benzyloxy)-2-(5-{[(2,5-dihydroxyphenyl)methyl]amino}-2-hydroxyphenyl)acetamide |
Formula | C22H22N2O5 |
Mass | 394.4205 |
Exact Mass | 394.1528718 |
Composition | C (66.99%), H (5.62%), N (7.1%), O (20.28%) |
Atom Count | 51 |
PI | 6.55 |
Smiles | c1(c(ccc(c1)O)O)CNc1cc(CC(=O)NOCc2ccccc2)c(cc1)O |
InChI | 1S/C22H22N2O5/c25-19-7-9-21(27)17(11-19)13-23-18-6-8-20(26)16(10-18)12-22(28)24-29-14-15-4-2-1-3-5-1
5/h1-11,23,25-27H,12-14H2,(H,24,28) |
InChIKey | NYVYOBPBOHULAP-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0002892.png) | Structure Backbone | ![](./frame/f_EGIN0002892.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 |
10453233
|
Drug Bank Link | - |
ChemSpider Link | 8628649 |
ChEMBL Link | CHEMBL352589 |