General Property |
Molceule ID (DB) | EGIN0002599 |
Inhibitor Class | Amino-salicylate |
Molecule Name in Refrence Article | 5 compound |
IUPAC Name | methyl 5-{[(2,5-dimethoxyphenyl)methyl]amino}-2-hydroxybenzoate |
Formula | C17H19NO5 |
Mass | 317.3365 |
Exact Mass | 317.1263227 |
Composition | C (64.34%), H (6.03%), N (4.41%), O (25.21%) |
Atom Count | 42 |
PI | 7.43 |
Smiles | c1(C(=O)OC)c(ccc(c1)NCc1c(ccc(c1)OC)OC)O |
InChI | 1S/C17H19NO5/c1-21-13-5-7-16(22-2)11(8-13)10-18-12-4-6-15(19)14(9-12)17(20)23-3/h4-9,18-19H,10H2,1-3
H3 |
InChIKey | SDVVEJQOJJTQBH-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0002599.png) | Structure Backbone | ![](./frame/f_EGIN0002599.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 | 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 |
10335960
|
Drug Bank Link | - |
ChemSpider Link | 8511419 |
ChEMBL Link | CHEMBL334739 |