| General Property |
| Molceule ID (DB) | EGIN0002184 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP43 |
| IUPAC Name | 6-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-1H-indole-3-carbaldehyde |
| Formula | C17H16N6O |
| Mass | 320.3485 |
| Exact Mass | 320.1385592 |
| Composition | C (63.74%), H (5.03%), N (26.23%), O (4.99%) |
| Atom Count | 40 |
| PI | 9.91 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cc2c(cc1)c(c[nH]2)C=O |
| InChI | 1S/C17H16N6O/c1-9(2)23-17-14(16(18)20-8-21-17)15(22-23)10-3-4-12-11(7-24)6-19-13(12)5-10/h3-9,19H,1-
2H3,(H2,18,20,21) |
| InChIKey | QRJVSLZNMWIKRS-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 |
52945348
|
| Drug Bank Link | - |
| ChemSpider Link | 26353247 |
| ChEMBL Link | CHEMBL1242666 |
