| General Property |
| Molceule ID (DB) | EGIN0002300 |
| Inhibitor Class | Thiazolo-pyrimidine |
| Molecule Name in Refrence Article | 6d compound |
| IUPAC Name | 4-({7-[(3-bromophenyl)amino]-[1,3]thiazolo[4,5-d]pyrimidin-2-yl}amino)benzene-1-sulfonamide |
| Formula | C17H13BrN6O2S2 |
| Mass | 477.358 |
| Exact Mass | 475.9724777 |
| Composition | C (42.77%), H (2.74%), Br (16.74%), N (17.61%), O (6.7%), S (13.43%) |
| Atom Count | 41 |
| PI | 7.04 |
| Smiles | n1c(sc2c1ncnc2Nc1cc(ccc1)Br)Nc1ccc(cc1)S(=O)(=O)N |
| InChI | 1S/C17H13BrN6O2S2/c18-10-2-1-3-12(8-10)22-15-14-16(21-9-20-15)24-17(27-14)23-11-4-6-13(7-5-11)28(19,
25)26/h1-9H,(H2,19,25,26)(H2,20,21,22,23,24) |
| InChIKey | DXXVAXOWZWEBHE-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 | 19286381 |
| 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 |
44592211
|
| Drug Bank Link | - |
| ChemSpider Link | 24694398 |
| ChEMBL Link | CHEMBL469354 |
