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SMILES: CN(C)C(CNC(=S)Nc1cccc(C)c1)c1cccnc1

InChI Key: InChIKey=FAEPGMOWWWEYCC-UHFFFAOYSA-N

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 = 83319   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM83319
PNG
(1-[2-(dimethylamino)-2-(3-pyridinyl)ethyl]-3-(3-me...)
Show SMILES CN(C)C(CNC(=S)Nc1cccc(C)c1)c1cccnc1
Show InChI InChI=1S/C17H22N4S/c1-13-6-4-8-15(10-13)20-17(22)19-12-16(21(2)3)14-7-5-9-18-11-14/h4-11,16H,12H2,1-3H3,(H2,19,20,22)
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PCBioAssay
n/an/an/an/a>9.25E+4n/an/an/an/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 (2011)


BindingDB Entry DOI: 10.7270/Q22V2DN3
More data for this
Ligand-Target Pair