BDBM50054131 2-[2-(4-Chloro-phenyl)-1-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinolin-3-yl]-N,N-dihexyl-acetamide::CHEMBL335049

SMILES: CCCCCCN(CCCCCC)C(=O)Cc1n(-c2ccc(Cl)cc2)c(=O)c2cc3ccccc3[nH]c12

InChI Key: InChIKey=JJIMCMCBKRVGJH-UHFFFAOYSA-N

Data: 1 IC50

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 = 50054131   

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
Peripheral-Type Benzodiazepine Receptor (Rattus norvegicus (rat))	BDBM50054131 (2-[2-(4-Chloro-phenyl)-1-oxo-2,3-dihydro-1H-pyrrol...) Show SMILES CCCCCCN(CCCCCC)C(=O)Cc1n(-c2ccc(Cl)cc2)c(=O)c2cc3ccccc3[nH]c12 Show InChI InChI=1S/C31H38ClN3O2/c1-3-5-7-11-19-34(20-12-8-6-4-2)29(36)22-28-30-26(21-23-13-9-10-14-27(23)33-30)31(37)35(28)25-17-15-24(32)16-18-25/h9-10,13-18,21,33H,3-8,11-12,19-20,22H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Università di Siena Curated by ChEMBL					Assay Description Binding affinity against peripheral benzodiazepine receptor( PBR).				J Med Chem 39: 4275-84 (1996) Article DOI: 10.1021/jm960325j BindingDB Entry DOI: 10.7270/Q22F7MHJ
					More data for this Ligand-Target Pair