BDBM47852 2-[(2-Benzotriazol-1-yl-acetyl)-cyclopropyl-amino]-N-(4-fluoro-phenyl)-2-(3-methoxy-phenyl)-acetamide::2-[2-(benzotriazol-1-yl)ethanoyl-cyclopropyl-amino]-N-(4-fluorophenyl)-2-(3-methoxyphenyl)ethanamide::2-[[2-(1-benzotriazolyl)-1-oxoethyl]-cyclopropylamino]-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide::2-[[2-(benzotriazol-1-yl)acetyl]-cyclopropyl-amino]-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide::2-[[2-(benzotriazol-1-yl)acetyl]-cyclopropylamino]-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide::MLS000555702::SMR000173067::cid_3202425
SMILES: COc1cccc(c1)C(N(C1CC1)C(=O)Cn1nnc2ccccc12)C(=O)Nc1ccc(F)cc1
InChI Key: InChIKey=ILEVGKHONQXHOB-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) | BDBM47852 (2-[(2-Benzotriazol-1-yl-acetyl)-cyclopropyl-amino]...) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.05E+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 |