| General Property |
| Molceule ID (DB) | EGIN0002079 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP34 |
| IUPAC Name | 5-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-3-methylthiophene-2-carbaldehyde |
| Formula | C14H15N5OS |
| Mass | 301.367 |
| Exact Mass | 301.0997308 |
| Composition | C (55.8%), H (5.02%), N (23.24%), O (5.31%), S (10.64%) |
| Atom Count | 36 |
| PI | 13.06 |
| Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cc(c(s1)C=O)C |
| InChI | 1S/C14H15N5OS/c1-7(2)19-14-11(13(15)16-6-17-14)12(18-19)9-4-8(3)10(5-20)21-9/h4-7H,1-3H3,(H2,15,16,1
7) |
| InChIKey | JFJRIADKVAOEDG-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 |
24905157
|
| Drug Bank Link | - |
| ChemSpider Link | 24605304 |
| ChEMBL Link | CHEMBL1241947 |
