BDBM31518 Naphthyl and Benzamide Derivative, 14::racemic

SMILES: CCC(NC(=O)c1ccccc1C)c1ccc2ccccc2c1

InChI Key: InChIKey=FLAJIDWIIUVVEB-UHFFFAOYSA-N

Data: 1 Other

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 31518   

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
SARS Coronavirus Coronavirus Papain-Like Protease (Human SARS coronavirus (SARS-CoV))	BDBM31518 (Naphthyl and Benzamide Derivative, 14 | racemic) Show SMILES CCC(NC(=O)c1ccccc1C)c1ccc2ccccc2c1 Show InChI InChI=1S/C21H21NO/c1-3-20(22-21(23)19-11-7-4-8-15(19)2)18-13-12-16-9-5-6-10-17(16)14-18/h4-14,20H,3H2,1-2H3,(H,22,23)	PDB MMDB B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	n/a	n/a	n/a	7.5	23
Purdue University					Assay Description IC50 values for all inhibitors were determined using a 96-well plate based assay. Reactions were performed in buffer containing RLRGG-AMC, 2% DMSO, a...				J Med Chem 52: 5228-40 (2009) Article DOI: 10.1021/jm900611t BindingDB Entry DOI: 10.7270/Q2P8497Z
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