General Property |
Molceule ID (DB) | EGIN0002115 |
Inhibitor Class | Pyrazolo-pyrimidine |
Molecule Name in Refrence Article | PP133 |
IUPAC Name | 2-{4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}phenol |
Formula | C11H9N5O |
Mass | 227.2221 |
Exact Mass | 227.0807099 |
Composition | C (58.14%), H (3.99%), N (30.82%), O (7.04%) |
Atom Count | 26 |
PI | 7.52 |
Smiles | n1cnc2c(c1N)c(n[nH]2)c1c(cccc1)O |
InChI | 1S/C11H9N5O/c12-10-8-9(6-3-1-2-4-7(6)17)15-16-11(8)14-5-13-10/h1-5,17H,(H3,12,13,14,15,16) |
InChIKey | SPCDTCWCGHTEOV-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 | 24605201 |
ChEMBL Link | CHEMBL1242209 |