BDBM47875 1,5-Diisopropyl-3,7-bis-(2-nitro-benzoyl)-3,7-diaza-bicyclo[3.3.1]nonan-9-one::1,5-diisopropyl-3,7-bis(2-nitrobenzoyl)-3,7-diazabicyclo[3.3.1]nonan-9-one::3,7-bis(2-nitrobenzoyl)-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one::3,7-bis[(2-nitrophenyl)-oxomethyl]-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one::3,7-bis[(2-nitrophenyl)carbonyl]-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one::MLS000767535::SMR000429865::cid_1420934
SMILES: CC(C)C12CN(CC(CN(C1)C(=O)c1ccccc1[N+]([O-])=O)(C(C)C)C2=O)C(=O)c1ccccc1[N+]([O-])=O
InChI Key: InChIKey=ZILPRFMCZHSYGZ-UHFFFAOYSA-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 |
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3C-like protease (Avian infectious bronchitis virus) | BDBM47875 (1,5-Diisopropyl-3,7-bis-(2-nitro-benzoyl)-3,7-diaz...) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.11E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q29K48NM | |||||||||||
More data for this Ligand-Target Pair |