Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Polymerase basic protein 2 | ||
| Ligand | BDBM50507252 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1829449 (CHEMBL4329323) | ||
| EC50 | 450±n/a nM | ||
| Citation |  Xiong, J; Wang, J; Hu, G; Zhao, W; Li, J Design, synthesis and biological evaluation of novel, orally bioavailable pyrimidine-fused heterocycles as influenza PB2 inhibitors. Eur J Med Chem162:249-265 (2019) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Polymerase basic protein 2 | |||
| Name: | Polymerase basic protein 2 | ||
| Synonyms: | PB2 | PB2_I34A1 | Polymerase basic protein 2 | RNA-directed RNA polymerase subunit P3 | ||
| Type: | PROTEIN | ||
| Mol. Mass.: | 86120.80 | ||
| Organism: | Influenza A virus (strain A/Puerto Rico/8/1934 H1N1) | ||
| Description: | ChEMBL_109460 | ||
| Residue: | 759 | ||
| Sequence: |
| ||
| BDBM50507252 | |||
| n/a | |||
| Name | BDBM50507252 | ||
| Synonyms: | CHEMBL4548835 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C25H24FN5O2 | ||
| Mol. Mass. | 445.4888 | ||
| SMILES | Cc1cccc2nc(N[C@H]3C4CCC(CC4)[C@@H]3C(O)=O)nc(-c3c[nH]c4ncc(F)cc34)c12 |r,wU:16.18,wD:9.8,(31.2,-43.44,;30.71,-41.99,;29.21,-41.7,;28.71,-40.24,;29.72,-39.09,;31.22,-39.39,;32.24,-38.23,;33.75,-38.54,;35.08,-37.76,;36.42,-38.51,;36.42,-40.07,;37.76,-40.83,;39.1,-40.05,;39.09,-38.5,;38.31,-39.68,;37.19,-38.77,;37.74,-37.73,;37.73,-36.18,;36.38,-35.41,;39.07,-35.39,;34.24,-40,;33.21,-41.14,;33.7,-42.6,;32.79,-43.86,;33.71,-45.11,;35.18,-44.63,;36.53,-45.4,;37.87,-44.63,;37.86,-43.07,;39.21,-42.28,;36.52,-42.3,;35.18,-43.08,;31.71,-40.84,)| | ||
| Structure | 
| ||