| General Property |
| Molceule ID (DB) | EGIN0002200 |
| Inhibitor Class | Pyrazolo-pyrimidine |
| Molecule Name in Refrence Article | PP493 |
| IUPAC Name | 5-{4-amino-1-cyclopentyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-bromophenol |
| Formula | C16H16BrN5O |
| Mass | 374.235 |
| Exact Mass | 373.0538228 |
| Composition | C (51.35%), H (4.31%), Br (21.35%), N (18.71%), O (4.28%) |
| Atom Count | 39 |
| PI | 7.11 |
| Smiles | n1cnc2c(c1N)c(nn2C1CCCC1)c1cc(c(cc1)Br)O |
| InChI | 1S/C16H16BrN5O/c17-11-6-5-9(7-12(11)23)14-13-15(18)19-8-20-16(13)22(21-14)10-3-1-2-4-10/h5-8,10,23H,
1-4H2,(H2,18,19,20) |
| InChIKey | LVUGPVDXTSJQQD-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 |
24905333
|
| Drug Bank Link | - |
| ChemSpider Link | 24605125 |
| ChEMBL Link | CHEMBL1242376 |
