| General Property |
| Molceule ID (DB) | EGIN0002090 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP485 |
| IUPAC Name | 1-tert-butyl-3-(3,4-dimethoxyphenyl)-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 | 13.12 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)(C)C)c1cc(c(cc1)OC)OC |
| InChI | 1S/C17H21N5O2/c1-17(2,3)22-16-13(15(18)19-9-20-16)14(21-22)10-6-7-11(23-4)12(8-10)24-5/h6-9H,1-5H3,(
H2,18,19,20) |
| InChIKey | WLLDKVYCGDHDLF-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 |
24905330
|
| Drug Bank Link | - |
| ChemSpider Link | 24605128 |
| ChEMBL Link | CHEMBL1242379 |
