General Property |
Molceule ID (DB) | EGIN0002144 |
Inhibitor Class | Pyrazolo-pyrimidine |
Molecule Name in Refrence Article | PP201 |
IUPAC Name | 3-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
Formula | C12H11N5 |
Mass | 225.2492 |
Exact Mass | 225.1014454 |
Composition | C (63.99%), H (4.92%), N (31.09%) |
Atom Count | 28 |
PI | 7.96 |
Smiles | n1cnc2c(c1N)c(n[nH]2)c1ccc(cc1)C |
InChI | 1S/C12H11N5/c1-7-2-4-8(5-3-7)10-9-11(13)14-6-15-12(9)17-16-10/h2-6H,1H3,(H3,13,14,15,16,17) |
InChIKey | OXCDRCGLQPSXNL-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 |
24905250
|
Drug Bank Link | DB01809 |
ChemSpider Link | 24605209 |
ChEMBL Link | CHEMBL1241142 |