| General Property |
| Molceule ID (DB) | EGIN0002206 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP53 |
| IUPAC Name | 1-(propan-2-yl)-3-(pyrimidin-5-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Formula | C12H13N7 |
| Mass | 255.2785 |
| Exact Mass | 255.1232435 |
| Composition | C (56.46%), H (5.13%), N (38.41%) |
| Atom Count | 32 |
| PI | 13.1 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cncnc1 |
| InChI | 1S/C12H13N7/c1-7(2)19-12-9(11(13)16-6-17-12)10(18-19)8-3-14-5-15-4-8/h3-7H,1-2H3,(H2,13,16,17) |
| InChIKey | UAKWDILRCZKWFX-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 |
24905171
|
| Drug Bank Link | - |
| ChemSpider Link | 24605290 |
| ChEMBL Link | CHEMBL1241391 |
