General Property |
Molceule ID (DB) | EGIN0002143 |
Inhibitor Class | Pyrazolo-pyrimidine |
Molecule Name in Refrence Article | PP17 |
IUPAC Name | 6-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]naphthalen-2-ol |
Formula | C18H17N5O |
Mass | 319.3605 |
Exact Mass | 319.1433102 |
Composition | C (67.7%), H (5.37%), N (21.93%), O (5.01%) |
Atom Count | 41 |
PI | 8.17 |
Smiles | n1cnc2c(c1N)c(nn2C(C)C)c1cc2c(cc1)cc(cc2)O |
InChI | 1S/C18H17N5O/c1-10(2)23-18-15(17(19)20-9-21-18)16(22-23)13-4-3-12-8-14(24)6-5-11(12)7-13/h3-10,24H,1
-2H3,(H2,19,20,21) |
InChIKey | JCMWWPAJCOQLAF-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
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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 |
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Drug Bank Link | - |
ChemSpider Link | 24605119 |
ChEMBL Link | CHEMBL1242662 |