| General Property |
| Molceule ID (DB) | EGIN0002180 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP41 |
| IUPAC Name | 3-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]benzene-1-sulfonamide |
| Formula | C14H16N6O2S |
| Mass | 332.381 |
| Exact Mass | 332.1055445 |
| Composition | C (50.59%), H (4.85%), N (25.28%), O (9.63%), S (9.65%) |
| Atom Count | 39 |
| PI | 8.31 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cc(ccc1)S(=O)(=O)N |
| InChI | 1S/C14H16N6O2S/c1-8(2)20-14-11(13(15)17-7-18-14)12(19-20)9-4-3-5-10(6-9)23(16,21)22/h3-8H,1-2H3,(H2,
15,17,18)(H2,16,21,22) |
| InChIKey | WDMOOFMBMGLZGY-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 | 18849971 |
| 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 |
24905162
|
| Drug Bank Link | - |
| ChemSpider Link | 24605299 |
| ChEMBL Link | CHEMBL1242031 |
