BDBM84220 MLS000538530::N-[2-(4-allyl-5-{[2-(3-nitrophenyl)-2-oxoethyl]thio}-4H-1,2,4-triazol-3-yl)ethyl]-2-thiophenecarboxamide::N-[2-[4-allyl-5-[[2-keto-2-(3-nitrophenyl)ethyl]thio]-1,2,4-triazol-3-yl]ethyl]thiophene-2-carboxamide::N-[2-[5-[2-(3-nitrophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]thiophene-2-carboxamide::N-[2-[5-[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]thiophene-2-carboxamide::N-[2-[5-[[2-(3-nitrophenyl)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]-2-thiophenecarboxamide::SMR000144567::cid_2231941

SMILES: [O-][N+](=O)c1cccc(c1)C(=O)CSc1nnc(CCNC(=O)c2cccs2)n1CC=C

InChI Key: InChIKey=GHYKGSRSTVMMLM-UHFFFAOYSA-N

Data: 1 EC50

Find this compound or compounds like it in BindingDB or PDB:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 84220   

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
Beta-2 adrenergic receptor (Human)	BDBM84220 (MLS000538530 | N-[2-[5-[2-(3-nitrophenyl)-2-oxoeth...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	133	n/a	n/a	n/a	n/a
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