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BDBM11304 Compound 2 analog 15::MurB inhibitor (compound 16)::[5-(2-phenylethynyl)furan-2-yl]({[5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl})methanone::acs.jmedchem.1c00409_ST.327::med.21724, Compound 148
SMILES: FC(F)(F)c1nnc(SC(=O)c2ccc(o2)C#Cc2ccccc2)[nH]1
InChI Key: InChIKey=VNGWUVBXUIDQTK-UHFFFAOYSA-N
| Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Replicase polyprotein 1ab (SARS-CoV) | BDBM11304![]() (MurB inhibitor (compound 16) | [5-(2-phenylethynyl...) | GoogleScholar | UniChem | n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| UDP-N-acetylenolpyruvoylglucosamine reductase (Staphylococcus aureus) | BDBM11304![]() (MurB inhibitor (compound 16) | [5-(2-phenylethynyl...) | GoogleScholar | UniChem | n/a | n/a | n/a | 170 | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Replicase polyprotein 1ab (SARS-CoV) | BDBM11304![]() (MurB inhibitor (compound 16) | [5-(2-phenylethynyl...) | GoogleScholar | UniChem | n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Replicase polyprotein 1ab (SARS-CoV) | BDBM11304![]() (MurB inhibitor (compound 16) | [5-(2-phenylethynyl...) | GoogleScholar | UniChem | n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Replicase polyprotein 1ab (SARS-CoV) | BDBM11304![]() (MurB inhibitor (compound 16) | [5-(2-phenylethynyl...) | GoogleScholar | UniChem | n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||