| General Property |
| Molceule ID (DB) | EGIN0002078 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP327 |
| IUPAC Name | 5-{4-amino-1-[(2S)-butan-2-yl]-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methylphenol |
| Formula | C16H19N5O |
| Mass | 297.355 |
| Exact Mass | 297.1589603 |
| Composition | C (64.63%), H (6.44%), N (23.55%), O (5.38%) |
| Atom Count | 41 |
| PI | 8.24 |
| Smiles | n1cnc2c(c1N)c(nn2[C@@H](C)CC)c1cc(c(cc1)C)O |
| InChI | 1S/C16H19N5O/c1-4-10(3)21-16-13(15(17)18-8-19-16)14(20-21)11-6-5-9(2)12(22)7-11/h5-8,10,22H,4H2,1-3H
3,(H2,17,18,19)/t10-/m0/s1 |
| InChIKey | YKDLGDBIORZVLP-JTQLQIEISA-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 |
-
|
| Drug Bank Link | - |
| ChemSpider Link | 24605170 |
| ChEMBL Link | CHEMBL1242109 |
