BDBM105198 5‐bromo‐3‐hydroxy‐1,2‐dihydropyridin‐2‐one (Compound 2)
SMILES: Oc1cc(Br)c[nH]c1=O
InChI Key: InChIKey=KXBXUHWCODHRHK-UHFFFAOYSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
H1N1 Endonuclease (2009 H1N1 Influenza) | BDBM105198 (5‐bromo‐3‐hydroxy‐1,2̴...) | PDB MMDB B.MOAD GoogleScholar AffyNet | Purchase MCE MMDB PC cid PC sid PDB UniChem | PDB Article PubMed | n/a | n/a | 1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Rutgers University | Assay Description Cocktails of 4-8 compounds were used for the initial screening with single compound soaks to verify the bound fragment identity and to rule out coope... | ACS Chem Biol 8: 2501-8 (2013) Article DOI: 10.1021/cb400400j BindingDB Entry DOI: 10.7270/Q28W3BZW | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |