BDBM44842 2-(4-Chloro-benzylsulfanyl)-5,6,7,8-tetrahydro-quinoline-3-carbonitrile::2-[(4-chlorobenzyl)thio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile::2-[(4-chlorophenyl)methylsulfanyl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile::2-[(4-chlorophenyl)methylthio]-5,6,7,8-tetrahydroquinoline-3-carbonitrile::MLS000525730::SMR000116204::cid_697581

SMILES: Clc1ccc(CSc2nc3CCCCc3cc2C#N)cc1

InChI Key: InChIKey=KVTWMYWRYGBQQW-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 = 44842   

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
Multidrug resistance-associated protein 1 (Human)	BDBM44842 (SMR000116204 | cid_697581 | MLS000525730 | 2-[(4-c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	5.76E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair