| General Property |
| Molceule ID (DB) | EGIN0002108 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP120 |
| IUPAC Name | 1-methyl-3-{1H-pyrrolo[2,3-b]pyridin-5-yl}-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Formula | C13H11N7 |
| Mass | 265.2733 |
| Exact Mass | 265.1075934 |
| Composition | C (58.86%), H (4.18%), N (36.96%) |
| Atom Count | 31 |
| PI | 10.78 |
| Smiles | n1cnc2c(c1N)c(nn2C)c1cc2c(nc1)[nH]cc2 |
| InChI | 1S/C13H11N7/c1-20-13-9(11(14)17-6-18-13)10(19-20)8-4-7-2-3-15-12(7)16-5-8/h2-6H,1H3,(H,15,16)(H2,14,
17,18) |
| InChIKey | PGXQNHGXDFCMOJ-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 |
24905210
|
| Drug Bank Link | DB08052 |
| ChemSpider Link | 24605249 |
| ChEMBL Link | CHEMBL1240565 |
