| General Property |
| Molceule ID (DB) | EGIN0002080 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP343 |
| IUPAC Name | 3-(4-ethoxy-3-methoxyphenyl)-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Formula | C17H21N5O2 |
| Mass | 327.3809 |
| Exact Mass | 327.1695249 |
| Composition | C (62.37%), H (6.47%), N (21.39%), O (9.77%) |
| Atom Count | 45 |
| PI | 13.13 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cc(c(cc1)OCC)OC |
| InChI | 1S/C17H21N5O2/c1-5-24-12-7-6-11(8-13(12)23-4)15-14-16(18)19-9-20-17(14)22(21-15)10(2)3/h6-10H,5H2,1-
4H3,(H2,18,19,20) |
| InChIKey | AMERZUAKIAGPBA-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 |
24905282
|
| Drug Bank Link | - |
| ChemSpider Link | 24605166 |
| ChEMBL Link | CHEMBL1242472 |
