| General Property |
| Molceule ID (DB) | EGIN0002949 |
| Inhibitor Class | Benzo-thiazole |
| Molecule Name in Refrence Article | 3b |
| IUPAC Name | 2-(4-hydroxyphenyl)-1,3-benzothiazole-4,6-diol |
| Formula | C13H9NO3S |
| Mass | 259.28 |
| Exact Mass | 259.0303138 |
| Composition | C (60.22%), H (3.5%), N (5.4%), O (18.51%), S (12.37%) |
| Atom Count | 27 |
| PI | 4.59 |
| Smiles | n1c(sc2c1c(cc(c2)O)O)c1ccc(cc1)O |
| InChI | 1S/C13H9NO3S/c15-8-3-1-7(2-4-8)13-14-12-10(17)5-9(16)6-11(12)18-13/h1-6,15-17H |
| InChIKey | PGOFDBJJAGTOMR-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 | 8201603 |
| 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 |
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| Drug Bank Link | - |
| ChemSpider Link | 23141036 |
| ChEMBL Link | CHEMBL45564 |
