BDBM80058 2-chloranyl-3-(2-phenylethylamino)naphthalene-1,4-dione::2-chloro-3-(2-phenylethylamino)naphthalene-1,4-dione::2-chloro-3-(phenethylamino)-1,4-naphthoquinone::MLS002608293::SMR001527044::cid_237490

SMILES: Oc1c(Cl)c(N=CCc2ccccc2)c(O)c2ccccc12

InChI Key: InChIKey=CXPKKSMRVXUFNA-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 80058   

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-galactosidase (Escherichia coli)	BDBM80058 (MLS002608293 | SMR001527044 | 2-chloranyl-3-(2-phe...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>6.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
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C-C chemokine receptor type 6 (Human)	BDBM80058 (MLS002608293 | SMR001527044 | 2-chloranyl-3-(2-phe...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Hexokinase HKDC1 [W721R] (Human)	BDBM80058 (MLS002608293 | SMR001527044 | 2-chloranyl-3-(2-phe...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.92E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Hexokinase HKDC1 [W721R] (Human)	BDBM80058 (MLS002608293 | SMR001527044 | 2-chloranyl-3-(2-phe...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.85E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Toll-like receptor 9 (Human)	BDBM80058 (MLS002608293 | SMR001527044 | 2-chloranyl-3-(2-phe...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.79E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-lactamase (Pseudomonas aeruginosa)	BDBM80058 (MLS002608293 | SMR001527044 | 2-chloranyl-3-(2-phe...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.77E+4	n/a	n/a	n/a	n/a	n/a	n/a
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