General Property |
Molceule ID (DB) | EGIN0002196 |
Inhibitor Class | Pyrazolo-pyrimidine |
Molecule Name in Refrence Article | PP48 |
IUPAC Name | 3-(4-methoxyphenyl)-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
Formula | C15H17N5O |
Mass | 283.3284 |
Exact Mass | 283.1433102 |
Composition | C (63.59%), H (6.05%), N (24.72%), O (5.65%) |
Atom Count | 38 |
PI | 13.13 |
Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1ccc(cc1)OC |
InChI | 1S/C15H17N5O/c1-9(2)20-15-12(14(16)17-8-18-15)13(19-20)10-4-6-11(21-3)7-5-10/h4-9H,1-3H3,(H2,16,17,1
8) |
InChIKey | DUPSNQFPAJUAKA-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 |
24905168
|
Drug Bank Link | - |
ChemSpider Link | 24605293 |
ChEMBL Link | CHEMBL1242847 |