BDBM2494 (+/-)-4-Hydroxy.6-phenyl-3-[phenyl(phenylthio)methyl]-2H-pyran-2-one::4-hydroxy-6-phenyl-3-[phenyl(phenylsulfanyl)methyl]-2H-pyran-2-one::4-hydroxy-6-phenyl-pyranylthiomethane 24::C-3-substituted Pyran-2-one 3
SMILES: Oc1cc(oc(=O)c1C(Sc1ccccc1)c1ccccc1)-c1ccccc1
InChI Key: InChIKey=LVOUHVQQFFTPTD-UHFFFAOYSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
HIV-1 Protease (Human immunodeficiency virus type 1) | BDBM2494 ((+/-)-4-Hydroxy.6-phenyl-3-[phenyl(phenylthio)meth...) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 780 | n/a | n/a | n/a | n/a | 4.7 | 37 |
Parke-Davis Pharmaceutical Research | Assay Description For determination of IC50 values, HIV-1 protease was added to assay buffer containing inhibitor and the substrate (H-His-Lys-Ala-Arg-Val-Leu- (p-NO2)... | Bioorg Med Chem 4: 1401-10 (1996) Article DOI: 10.1016/j.bmcl.2004.12.068 BindingDB Entry DOI: 10.7270/Q2PZ571Q | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
HIV-1 Protease (Human immunodeficiency virus type 1) | BDBM2494 ((+/-)-4-Hydroxy.6-phenyl-3-[phenyl(phenylthio)meth...) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 780 | n/a | n/a | n/a | n/a | 4.7 | 37 |
Parke-Davis Pharmaceutical Research | Assay Description For determination of IC50 values, HIV-1 protease was added to assay buffer containing inhibitor and the substrate (H-His-Lys-Ala-Arg-Val-Leu- (p-NO2)... | J Med Chem 38: 898-905 (1995) Article DOI: 10.1021/jm00006a007 BindingDB Entry DOI: 10.7270/Q2348HJB | |||||||||||
More data for this Ligand-Target Pair |