| General Property |
| Molceule ID (DB) | EGIN0002112 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP129 |
| IUPAC Name | 3-(isoquinolin-6-yl)-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Formula | C17H16N6 |
| Mass | 304.3491 |
| Exact Mass | 304.1436445 |
| Composition | C (67.09%), H (5.3%), N (27.61%) |
| Atom Count | 39 |
| PI | 13.14 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cc2c(cc1)cncc2 |
| InChI | 1S/C17H16N6/c1-10(2)23-17-14(16(18)20-9-21-17)15(22-23)12-3-4-13-8-19-6-5-11(13)7-12/h3-10H,1-2H3,(H
2,18,20,21) |
| InChIKey | MLYMHKQJJPVNAP-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 |
24905215
|
| Drug Bank Link | - |
| ChemSpider Link | 24605244 |
| ChEMBL Link | CHEMBL1242207 |
