| General Property |
| Molceule ID (DB) | EGIN0002110 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP122 |
| IUPAC Name | 1-cyclopentyl-3-(quinolin-3-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Formula | C19H18N6 |
| Mass | 330.3864 |
| Exact Mass | 330.1592946 |
| Composition | C (69.07%), H (5.49%), N (25.44%) |
| Atom Count | 43 |
| PI | 13.12 |
| Smiles | n1cnc2c(c1N)c(nn2C1CCCC1)c1cc2c(nc1)cccc2 |
| InChI | 1S/C19H18N6/c20-18-16-17(13-9-12-5-1-4-8-15(12)21-10-13)24-25(14-6-2-3-7-14)19(16)23-11-22-18/h1,4-5
,8-11,14H,2-3,6-7H2,(H2,20,22,23) |
| InChIKey | FVPBLAKABVRLRX-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 |
24905211
|
| Drug Bank Link | - |
| ChemSpider Link | 24605248 |
| ChEMBL Link | CHEMBL1242755 |
