| General Property |
| Molceule ID (DB) | EGIN0002212 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP63 |
| IUPAC Name | 3-(2,5-difluoro-4-methoxyphenyl)-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Formula | C15H15F2N5O |
| Mass | 319.3093 |
| Exact Mass | 319.1244665 |
| Composition | C (56.42%), H (4.73%), F (11.9%), N (21.93%), O (5.01%) |
| Atom Count | 38 |
| PI | 13.1 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cc(c(cc1F)OC)F |
| InChI | 1S/C15H15F2N5O/c1-7(2)22-15-12(14(18)19-6-20-15)13(21-22)8-4-10(17)11(23-3)5-9(8)16/h4-7H,1-3H3,(H2,
18,19,20) |
| InChIKey | OUQOXXMJLDQZQC-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 |
24905176
|
| Drug Bank Link | - |
| ChemSpider Link | 24605284 |
| ChEMBL Link | CHEMBL1242027 |
