BDBM10261 3-nitro-N-(1,3,4-trioxo-1,2,3,4-tetrahydroisoquinolin-5-yl)benzamide::Isoquinoline-1,3,4-trione 6h::N-(1,3,4-Trioxo-1,2,3,4-tetrahydro-isoquinolin-5-yl)-3-nitrobenzamide

SMILES: O=C(Nc1cccc2C(=O)NC(=O)C(=O)c12)c1cccc(c1)N(=O)=O

InChI Key: InChIKey=MUHRCQVERAKWFB-UHFFFAOYSA-N

Data: 1 IC50

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 = 10261   

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
Caspase-3 (Human)	BDBM10261 (N-(1,3,4-Trioxo-1,2,3,4-tetrahydro-isoquinolin-5-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	53	n/a	n/a	n/a	n/a	7.5	35
TBA									Citation and Details
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