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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Polymerase basic protein 2 | ||
| Ligand | BDBM50507251 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1829449 (CHEMBL4329323) | ||
| EC50 | 2.6±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: |
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| BDBM50507251 | |||
| n/a | |||
| Name | BDBM50507251 | ||
| Synonyms: | CHEMBL4469158 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H22FN5O2S | ||
| Mol. Mass. | 439.506 | ||
| SMILES | OC(=O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(nc2CSCc12)-c1c[nH]c2ncc(F)cc12 |r,wU:3.2,wD:10.12,(41.42,-45.38,;42.75,-46.14,;44.09,-45.36,;42.77,-47.68,;44.11,-48.45,;44.12,-50,;42.79,-50.77,;41.46,-50.01,;42.22,-48.72,;43.34,-49.63,;41.45,-48.46,;40.12,-47.71,;38.8,-48.49,;39.28,-49.94,;38.26,-51.08,;36.76,-50.78,;36.27,-49.33,;34.87,-48.7,;35.03,-47.17,;36.54,-46.85,;37.3,-48.18,;38.74,-52.53,;37.84,-53.79,;38.75,-55.03,;40.22,-54.55,;41.56,-55.32,;42.9,-54.55,;42.89,-52.99,;44.23,-52.22,;41.56,-52.23,;40.21,-53.01,)| | ||
| Structure | 
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