BDBM50232963 CHEMBL4065523

SMILES: CCN(CC)c1nc(Nc2ccc(cc2)[N+]([O-])=O)nc(OC(C(F)(F)F)C(F)(F)F)n1

InChI Key: InChIKey=BYSPZQONSLKQKS-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 = 50232963   

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
Cystic fibrosis transmembrane conductance regulator (Homo sapiens (Human))	BDBM50232963 (CHEMBL4065523) Show SMILES CCN(CC)c1nc(Nc2ccc(cc2)[N+]([O-])=O)nc(OC(C(F)(F)F)C(F)(F)F)n1 Show InChI InChI=1S/C16H16F6N6O3/c1-3-27(4-2)13-24-12(23-9-5-7-10(8-6-9)28(29)30)25-14(26-13)31-11(15(17,18)19)16(20,21)22/h5-8,11H,3-4H2,1-2H3,(H,23,24,25,26)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Activation of human CFTR expressed in FRT cells co-expressing YFP assessed as increase in forskolin-stimulated iodide influx measured after 10 mins f...				J Med Chem 60: 1210-1218 (2017) BindingDB Entry DOI: 10.7270/Q2ZC8540
					More data for this Ligand-Target Pair