BDBM50300506 (S)-5-tert-Butyl-3-[7-(1,1-dioxo-1lambda*6*-[1,2]thiazinan-2-ylmethyl)-1,1-dioxo-1H-1lambda*6*-benzo[d]isothiazol-3-yl]-1-(4-fluoro-benzyl)-4-hydroxy-1,5-dihydro-pyrrol-2-one::CHEMBL576001
SMILES: CC(C)(C)[C@@H]1N(Cc2ccc(F)cc2)C(=O)C(C1=O)=C1NS(=O)(=O)c2c1cccc2CN1CCCCS1(=O)=O
InChI Key: InChIKey=YFAPVYMCOPNFPF-RUZDIDTESA-N
Data: 1 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
RNA polymerase (NS5B) (Hepatitis C virus (HCV)) | BDBM50300506 ((S)-5-tert-Butyl-3-[7-(1,1-dioxo-1lambda*6*-[1,2]t...) | PDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Palo Alto LLC Curated by ChEMBL | Assay Description Inhibition of HSV1b con1 NS5B polymerase assessed as [3H]UTP incorporation into acid insoluble RNA product | Bioorg Med Chem Lett 19: 5652-6 (2009) Article DOI: 10.1016/j.bmcl.2009.08.022 BindingDB Entry DOI: 10.7270/Q2N016K0 | |||||||||||
More data for this Ligand-Target Pair |