BDBM50228521 CHEMBL94945

SMILES: CC(CCCC(O)=O)c1cccc(OCc2ccc3ccccc3n2)c1

InChI Key: InChIKey=LSGRVFKVXFZMMC-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50228521   

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
Cysteinyl leukotriene receptor (Homo sapiens (Human))	BDBM50228521 (CHEMBL94945) Show SMILES CC(CCCC(O)=O)c1cccc(OCc2ccc3ccccc3n2)c1 Show InChI InChI=1S/C22H23NO3/c1-16(6-4-11-22(24)25)18-8-5-9-20(14-18)26-15-19-13-12-17-7-2-3-10-21(17)23-19/h2-3,5,7-10,12-14,16H,4,6,11,15H2,1H3,(H,24,25)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Rorer Central Research Curated by ChEMBL					Assay Description In vitro binding affinity against cysteinyl leukotriene D4 receptor from guinea pig lung membrane				J Med Chem 33: 2828-41 (1990) BindingDB Entry DOI: 10.7270/Q29C6WDM
					More data for this Ligand-Target Pair