BDBM50079900 7-Nitro-3-trifluoromethyl-1,2,3,4-tetrahydro-isoquinoline::7-nitro-3-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinoline::CHEMBL112351

SMILES: [O-][N+](=O)c1ccc2CC(NCc2c1)C(F)(F)F

InChI Key: InChIKey=AZEWYBRFBDWZGW-UHFFFAOYSA-N

Data: 5 KI

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 5 hits for monomerid = 50079900   

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
Phenylethanolamine N-methyltransferase (Bovine)	BDBM50079900 (7-nitro-3-(trifluoromethyl)-1,2,3,4-tetrahydroisoq...) Show SMILES Show InChI	GoogleScholar	UniChem		2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Phenylethanolamine N-methyltransferase (Human)	BDBM50079900 (7-nitro-3-(trifluoromethyl)-1,2,3,4-tetrahydroisoq...) Show SMILES Show InChI	GoogleScholar	UniChem		2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Alpha-2A adrenergic receptor (Human)	BDBM50079900 (7-nitro-3-(trifluoromethyl)-1,2,3,4-tetrahydroisoq...) Show SMILES Show InChI	GoogleScholar	UniChem		3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Phenylethanolamine N-methyltransferase (Bovine)	BDBM50079900 (7-nitro-3-(trifluoromethyl)-1,2,3,4-tetrahydroisoq...) Show SMILES Show InChI	GoogleScholar	UniChem		1.35E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Alpha-2A adrenergic receptor [16-465]/Alpha-2B adrenergic receptor/Alpha-2C adrenergic receptor (Rat)	BDBM50079900 (7-nitro-3-(trifluoromethyl)-1,2,3,4-tetrahydroisoq...) Show SMILES Show InChI	GoogleScholar	UniChem		1.50E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair