BDBM44173 2-[6-(4-Fluoro-phenyl)-pyridazin-3-ylsulfanyl]-1-(2-methyl-piperidin-1-yl)-ethanone::2-[6-(4-fluorophenyl)pyridazin-3-yl]sulfanyl-1-(2-methylpiperidin-1-yl)ethanone::2-[[6-(4-fluorophenyl)-3-pyridazinyl]thio]-1-(2-methyl-1-piperidinyl)ethanone::2-[[6-(4-fluorophenyl)pyridazin-3-yl]thio]-1-(2-methylpiperidino)ethanone::MLS000074578::SMR000007932::cid_645733

SMILES: CC1CCCCN1C(=O)CSc1ccc(nn1)-c1ccc(F)cc1

InChI Key: InChIKey=XUZOYIXODOVXGO-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 44173   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
electroneutral potassium-chloride cotransporter KCC2 (Homo sapiens (Human))	BDBM44173 (2-[6-(4-Fluoro-phenyl)-pyridazin-3-ylsulfanyl]-1-(...) Show SMILES CC1CCCCN1C(=O)CSc1ccc(nn1)-c1ccc(F)cc1 Show InChI InChI=1S/C18H20FN3OS/c1-13-4-2-3-11-22(13)18(23)12-24-17-10-9-16(20-21-17)14-5-7-15(19)8-6-14/h5-10,13H,2-4,11-12H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	3.78E+3	n/a	n/a	n/a	n/a
Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Curated by PubChem BioAssay					Assay Description Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2M32T6M
					More data for this Ligand-Target Pair
electroneutral potassium-chloride cotransporter KCC2 (Homo sapiens (Human))	BDBM44173 (2-[6-(4-Fluoro-phenyl)-pyridazin-3-ylsulfanyl]-1-(...) Show SMILES CC1CCCCN1C(=O)CSc1ccc(nn1)-c1ccc(F)cc1 Show InChI InChI=1S/C18H20FN3OS/c1-13-4-2-3-11-22(13)18(23)12-24-17-10-9-16(20-21-17)14-5-7-15(19)8-6-14/h5-10,13H,2-4,11-12H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	8.19E+6	n/a	n/a	n/a	n/a
Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Curated by PubChem BioAssay					Assay Description Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2Q52N1X
					More data for this Ligand-Target Pair