BDBM50379279 CHEMBL2011502

SMILES: CC[C@@H](NCc1cccc(c1)C(=O)NCCOc1ccccc1)c1ccccc1

InChI Key: InChIKey=JDTVIASCYMIUAX-XMMPIXPASA-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 = 50379279   

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
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50379279 (CHEMBL2011502) Show SMILES CC[C@@H](NCc1cccc(c1)C(=O)NCCOc1ccccc1)c1ccccc1 |r| Show InChI InChI=1S/C25H28N2O2/c1-2-24(21-11-5-3-6-12-21)27-19-20-10-9-13-22(18-20)25(28)26-16-17-29-23-14-7-4-8-15-23/h3-15,18,24,27H,2,16-17,19H2,1H3,(H,26,28)/t24-/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	4.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Broad Institute of Harvard and MIT Curated by ChEMBL					Assay Description Negative allosteric modulation at M2 receptor by AS-MS analysis				Bioorg Med Chem 20: 1979-89 (2012) Article DOI: 10.1016/j.bmc.2011.11.071 BindingDB Entry DOI: 10.7270/Q22J6CVS
					More data for this Ligand-Target Pair