General Property |
Molceule ID (DB) | EGIN0002923 |
Inhibitor Class | Amino-salicylate |
Molecule Name in Refrence Article | II36 compound |
IUPAC Name | naphthalen-2-yl 5-{[(2,5-dihydroxyphenyl)methyl]amino}-2-hydroxybenzoate |
Formula | C24H19NO5 |
Mass | 401.4114 |
Exact Mass | 401.1263227 |
Composition | C (71.81%), H (4.77%), N (3.49%), O (19.93%) |
Atom Count | 49 |
PI | 6.84 |
Smiles | c1(C(=O)Oc2cc3c(cc2)cccc3)c(ccc(c1)NCc1c(ccc(c1)O)O)O |
InChI | 1S/C24H19NO5/c26-19-7-10-22(27)17(11-19)14-25-18-6-9-23(28)21(13-18)24(29)30-20-8-5-15-3-1-2-4-16(15
)12-20/h1-13,25-28H,14H2 |
InChIKey | WLVCRXYEFILQSG-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
|
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 |
10408738
|
Drug Bank Link | - |
ChemSpider Link | 8584175 |
ChEMBL Link | CHEMBL169514 |