| General Property |
| Molceule ID (DB) | EGIN0002130 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP149 |
| IUPAC Name | N-(4-{4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}phenyl)-4-phenylbenzamide |
| Formula | C24H18N6O |
| Mass | 406.4393 |
| Exact Mass | 406.1542092 |
| Composition | C (70.92%), H (4.46%), N (20.68%), O (3.94%) |
| Atom Count | 49 |
| PI | 7.94 |
| Smiles | n1cnc2c(c1N)c(n[nH]2)c1ccc(cc1)NC(=O)c1ccc(cc1)c1ccccc1 |
| InChI | 1S/C24H18N6O/c25-22-20-21(29-30-23(20)27-14-26-22)17-10-12-19(13-11-17)28-24(31)18-8-6-16(7-9-18)15-
4-2-1-3-5-15/h1-14H,(H,28,31)(H3,25,26,27,29,30) |
| InChIKey | UTSMKWBXJSXTKR-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 |
52949497
|
| Drug Bank Link | - |
| ChemSpider Link | 26349583 |
| ChEMBL Link | CHEMBL1241861 |
