| General Property |
| Molceule ID (DB) | EGIN0002153 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP32 |
| IUPAC Name | 4-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-2-chlorobenzamide |
| Formula | C15H15ClN6O |
| Mass | 330.772 |
| Exact Mass | 330.0995868 |
| Composition | C (54.47%), H (4.57%), Cl (10.72%), N (25.41%), O (4.84%) |
| Atom Count | 38 |
| PI | 9.66 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cc(c(cc1)C(=O)N)Cl |
| InChI | 1S/C15H15ClN6O/c1-7(2)22-15-11(13(17)19-6-20-15)12(21-22)8-3-4-9(14(18)23)10(16)5-8/h3-7H,1-2H3,(H2,
18,23)(H2,17,19,20) |
| InChIKey | NZELPIPZPVLYLT-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 |
52942235
|
| Drug Bank Link | - |
| ChemSpider Link | 26352791 |
| ChEMBL Link | CHEMBL1241862 |
