| General Property |
| Molceule ID (DB) | EGIN0002158 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP333 |
| IUPAC Name | 5-{4-amino-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methylphenol |
| Formula | C13H13N5O |
| Mass | 255.2752 |
| Exact Mass | 255.1120101 |
| Composition | C (61.17%), H (5.13%), N (27.43%), O (6.27%) |
| Atom Count | 32 |
| PI | 8.26 |
| Smiles | n1cnc2c(c1N)c(nn2C)c1cc(c(cc1)C)O |
| InChI | 1S/C13H13N5O/c1-7-3-4-8(5-9(7)19)11-10-12(14)15-6-16-13(10)18(2)17-11/h3-6,19H,1-2H3,(H2,14,15,16) |
| InChIKey | GRWJFKQBVQNWQW-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 |
24905290
|
| Drug Bank Link | - |
| ChemSpider Link | 24605169 |
| ChEMBL Link | CHEMBL1241271 |
