General Property |
Molceule ID (DB) | EGIN0002114 |
Inhibitor Class | Pyrazolo-pyrimidine |
Molecule Name in Refrence Article | PP132 |
IUPAC Name | 1-(propan-2-yl)-3-(quinoxalin-6-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
Formula | C16H15N7 |
Mass | 305.3372 |
Exact Mass | 305.1388935 |
Composition | C (62.94%), H (4.95%), N (32.11%) |
Atom Count | 38 |
PI | 13.13 |
Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cc2c(cc1)nccn2 |
InChI | 1S/C16H15N7/c1-9(2)23-16-13(15(17)20-8-21-16)14(22-23)10-3-4-11-12(7-10)19-6-5-18-11/h3-9H,1-2H3,(H2
,17,20,21) |
InChIKey | AGEIBLLCZVGHLI-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 |
24905218
|
Drug Bank Link | - |
ChemSpider Link | 24605241 |
ChEMBL Link | CHEMBL1241774 |