| General Property |
| Molceule ID (DB) | EGIN0002215 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP66 |
| IUPAC Name | 3-(2,4-dimethoxypyrimidin-5-yl)-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Formula | C14H17N7O2 |
| Mass | 315.3305 |
| Exact Mass | 315.1443728 |
| Composition | C (53.32%), H (5.43%), N (31.09%), O (10.15%) |
| Atom Count | 40 |
| PI | 13.08 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1c(nc(nc1)OC)OC |
| InChI | 1S/C14H17N7O2/c1-7(2)21-12-9(11(15)17-6-18-12)10(20-21)8-5-16-14(23-4)19-13(8)22-3/h5-7H,1-4H3,(H2,1
5,17,18) |
| InChIKey | GTXKSDZLEOURPP-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 |
24905179
|
| Drug Bank Link | - |
| ChemSpider Link | 24605281 |
| ChEMBL Link | CHEMBL1242846 |
