General Property |
Molceule ID (DB) | EGIN0002154 |
Inhibitor Class | Pyrazolo-pyrimidine |
Molecule Name in Refrence Article | PP320 |
IUPAC Name | 5-{4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methylphenol |
Formula | C12H11N5O |
Mass | 241.2486 |
Exact Mass | 241.09636 |
Composition | C (59.74%), H (4.6%), N (29.03%), O (6.63%) |
Atom Count | 29 |
PI | 7.83 |
Smiles | n1cnc2c(c1N)c(n[nH]2)c1cc(c(cc1)C)O |
InChI | 1S/C12H11N5O/c1-6-2-3-7(4-8(6)18)10-9-11(13)14-5-15-12(9)17-16-10/h2-5,18H,1H3,(H3,13,14,15,16,17) |
InChIKey | ZTWYTYUOHYGWSG-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 |
24905285
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Drug Bank Link | - |
ChemSpider Link | 24605174 |
ChEMBL Link | CHEMBL1241270 |