| General Property |
| Molceule ID (DB) | EGIN0002133 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP152 |
| IUPAC Name | 4-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-2-fluorobenzaldehyde |
| Formula | C15H14FN5O |
| Mass | 299.303 |
| Exact Mass | 299.1182383 |
| Composition | C (60.19%), H (4.71%), F (6.35%), N (23.4%), O (5.35%) |
| Atom Count | 36 |
| PI | 13.13 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cc(c(cc1)C=O)F |
| InChI | 1S/C15H14FN5O/c1-8(2)21-15-12(14(17)18-7-19-15)13(20-21)9-3-4-10(6-22)11(16)5-9/h3-8H,1-2H3,(H2,17,1
8,19) |
| InChIKey | CMUZPNXYCOKJJJ-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 |
24905238
|
| Drug Bank Link | - |
| ChemSpider Link | 24605221 |
| ChEMBL Link | CHEMBL1241860 |
