BDBM114626 2-[4-(3,5-dimethoxybenzyl)piperazino]pyrimidine::2-[4-[(3,5-dimethoxyphenyl)methyl]-1-piperazinyl]pyrimidine::2-[4-[(3,5-dimethoxyphenyl)methyl]piperazin-1-yl]pyrimidine::SR-01000206683::SR-01000206683-3::cid_3724501

SMILES: COc1cc(CN2CCN(CC2)c2ncccn2)cc(OC)c1

InChI Key: InChIKey=RTLZCKPXOCEMBV-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 = 114626   

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
5-hydroxytryptamine receptor 2A (5HT2A) (Mus musculus (Mouse))	BDBM114626 (2-[4-(3,5-dimethoxybenzyl)piperazino]pyrimidine | ...) Show SMILES COc1cc(CN2CCN(CC2)c2ncccn2)cc(OC)c1 Show InChI InChI=1S/C17H22N4O2/c1-22-15-10-14(11-16(12-15)23-2)13-20-6-8-21(9-7-20)17-18-4-3-5-19-17/h3-5,10-12H,6-9,13H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	7.61E+4	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...				PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q24B2ZZ6
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM114626 (2-[4-(3,5-dimethoxybenzyl)piperazino]pyrimidine | ...) Show SMILES COc1cc(CN2CCN(CC2)c2ncccn2)cc(OC)c1 Show InChI InChI=1S/C17H22N4O2/c1-22-15-10-14(11-16(12-15)23-2)13-20-6-8-21(9-7-20)17-18-4-3-5-19-17/h3-5,10-12H,6-9,13H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	9.25E+4	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Assay Provider: Laura Bohn External Assay ID: OPRM1_AC...				PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q2833QNG
					More data for this Ligand-Target Pair