| General Property |
| Molceule ID (DB) | EGIN0002137 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP157 |
| IUPAC Name | 5-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-2-hydroxybenzonitrile |
| Formula | C15H14N6O |
| Mass | 294.3113 |
| Exact Mass | 294.1229091 |
| Composition | C (61.21%), H (4.79%), N (28.55%), O (5.44%) |
| Atom Count | 36 |
| PI | 7.01 |
| Smiles | CC(C)n1nc(c2c(N)ncnc12)c1cc(C#N)c(O)cc1 |
| InChI | InChI=1S/C15H14N6O/c1-8(2)21-15-12(14(17)18-7-19-15)13(20-21)9-3-4-11(22)10(5-9)6-16/h3-5,7-8,22H,1-
2H3,(H2,17,18,19) |
| InChIKey | InChIKey=LTWOJQSOPFKBFM-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 |
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| Drug Bank Link | - |
| ChemSpider Link | 24605217 |
| ChEMBL Link | - |
