| General Property |
| Molceule ID (DB) | EGIN0002237 |
| Inhibitor Class | Benzo-thiazole |
| Molecule Name in Refrence Article | 6 compound |
| IUPAC Name | 2-N-[4-(1,3-benzothiazol-2-yl)phenyl]-4-N,4-N-dimethylpyrimidine-2,4-diamine |
| Formula | C19H17N5S |
| Mass | 347.437 |
| Exact Mass | 347.1204663 |
| Composition | C (65.68%), H (4.93%), N (20.16%), S (9.23%) |
| Atom Count | 42 |
| PI | 9.35 |
| Smiles | c1c(ccc(c1)c1nc2c(s1)cccc2)Nc1nccc(n1)N(C)C |
| InChI | 1S/C19H17N5S/c1-24(2)17-11-12-20-19(23-17)21-14-9-7-13(8-10-14)18-22-15-5-3-4-6-16(15)25-18/h3-12H,1
-2H3,(H,20,21,23) |
| InChIKey | UTQLMOIUFSXMLI-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 | 19211246 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | Aurora A | Aurora B | InsR | VEGFR2 | ALL |
| Pub Chem Link |
-
|
| Drug Bank Link | - |
| ChemSpider Link | 23335765 |
| ChEMBL Link | CHEMBL462161 |
