BDBM92631 (3R)-3-{[(1S)-1-(4-chloro-2-fluoro-3-phenoxyphenyl)propyl]amino}butanamide, 7
SMILES: CC[C@H](N[C@H](C)CC(N)=O)c1ccc(Cl)c(Oc2ccccc2)c1F
InChI Key: InChIKey=DXPCUPMRYIXTFI-WBMJQRKESA-N
Data: 1 Kd
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
NS3 Protein (Hepatitis C virus) | BDBM92631 ((3R)-3-{[(1S)-1-(4-chloro-2-fluoro-3-phenoxyphenyl...) | PDB UniProtKB/TrEMBL GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 2.40E+4 | n/a | n/a | n/a | n/a | 25 |
Astex Pharmaceuticals | Assay Description The protease activity of the full-length NS3-NS4a and the protease domain were measured using a FRET-based assay using a peptide substrate derived fr... | Nat Chem Biol 8: 920-5 (2012) Article DOI: 10.1038/nchembio.1081 BindingDB Entry DOI: 10.7270/Q26Q1VVN | |||||||||||
More data for this Ligand-Target Pair |