| General Property |
| Molceule ID (DB) | EGIN0002139 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP159 |
| IUPAC Name | 3-(4-fluoro-1H-indazol-6-yl)-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Formula | C15H14FN7 |
| Mass | 311.317 |
| Exact Mass | 311.1294717 |
| Composition | C (57.87%), H (4.53%), F (6.1%), N (31.49%) |
| Atom Count | 37 |
| PI | 9.76 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cc2c(c(c1)F)cn[nH]2 |
| InChI | 1S/C15H14FN7/c1-7(2)23-15-12(14(17)18-6-19-15)13(22-23)8-3-10(16)9-5-20-21-11(9)4-8/h3-7H,1-2H3,(H,2
0,21)(H2,17,18,19) |
| InChIKey | VVLOLXBDTFEURK-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 |
24905244
|
| Drug Bank Link | - |
| ChemSpider Link | 24605215 |
| ChEMBL Link | CHEMBL1242573 |
