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SMILES: COc1ccc(cc1)C(CNC(=O)CCc1ccsc1)N(C)C

InChI Key: InChIKey=ORJGOUMNJNMVFR-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 83410   
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))		BDBM83410
PNG
(MLS001175046 | N-[2-(dimethylamino)-2-(4-methoxyph...)
Show SMILES COc1ccc(cc1)C(CNC(=O)CCc1ccsc1)N(C)C
Show InChI InChI=1S/C18H24N2O2S/c1-20(2)17(15-5-7-16(22-3)8-6-15)12-19-18(21)9-4-14-10-11-23-13-14/h5-8,10-11,13,17H,4,9,12H2,1-3H3,(H,19,21)
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PC cid
PC sid
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PCBioAssay
n/an/an/an/a 2.56E+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