| General Property |
| Molceule ID (DB) | EGIN0002131 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP150 |
| IUPAC Name | 5-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-2-fluorobenzonitrile |
| Formula | C15H13FN6 |
| Mass | 296.3023 |
| Exact Mass | 296.1185727 |
| Composition | C (60.8%), H (4.42%), F (6.41%), N (28.36%) |
| Atom Count | 35 |
| PI | 13.13 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cc(c(cc1)F)C#N |
| InChI | 1S/C15H13FN6/c1-8(2)22-15-12(14(18)19-7-20-15)13(21-22)9-3-4-11(16)10(5-9)6-17/h3-5,7-8H,1-2H3,(H2,1
8,19,20) |
| InChIKey | VMZGXVLGNHMKLW-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 |
24905236
|
| Drug Bank Link | - |
| ChemSpider Link | 24605223 |
| ChEMBL Link | CHEMBL1241680 |
