| General Property |
| Molceule ID (DB) | EGIN0002310 |
| Inhibitor Class | Thiazolo-pyrimidine |
| Molecule Name in Refrence Article | 6n compound |
| IUPAC Name | 7-N-(3-chloro-4-fluorophenyl)-2-N-{4-[2-(morpholin-4-yl)ethyl]phenyl}-[1,3]thiazolo[4,5-d]pyrimidine-2,7-diamine |
| Formula | C23H22ClFN6OS |
| Mass | 484.977 |
| Exact Mass | 484.124836 |
| Composition | C (56.96%), H (4.57%), Cl (7.31%), F (3.92%), N (17.33%), O (3.3%), S (6.61%) |
| Atom Count | 55 |
| PI | 9.96 |
| Smiles | n1c(sc2c1ncnc2Nc1cc(c(cc1)F)Cl)Nc1ccc(cc1)CCN1CCOCC1 |
| InChI | 1S/C23H22ClFN6OS/c24-18-13-17(5-6-19(18)25)28-21-20-22(27-14-26-21)30-23(33-20)29-16-3-1-15(2-4-16)7
-8-31-9-11-32-12-10-31/h1-6,13-14H,7-12H2,(H2,26,27,28,29,30) |
| InChIKey | YJCSNOSZBTYSKS-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 |
16036987
|
| Drug Bank Link | - |
| ChemSpider Link | 13165581 |
| ChEMBL Link | CHEMBL470012 |
