BDBM81808 CAS_133816::NSC_133816::WY 26392

SMILES CCCS(=O)(=O)N(C)C1CCN2CCc3ccccc3C2C1

InChI Key InChIKey=LJPDFKRYOKWXMQ-UHFFFAOYSA-N

Data  3 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 81808   

TargetAlpha-2C adrenergic receptor(OK)
University of Nebraska

Curated by PDSP Ki Database
LigandPNGBDBM81808(CAS_133816 | NSC_133816 | WY 26392)
Show SMILES CCCS(=O)(=O)N(C)C1CCN2CCc3ccccc3C2C1
Show InChI InChI=1S/C17H26N2O2S/c1-3-12-22(20,21)18(2)15-9-11-19-10-8-14-6-4-5-7-16(14)17(19)13-15/h4-7,15,17H,3,8-13H2,1-2H3
Affinity DataKi:  0.860nMMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAlpha-2B adrenergic receptor(NEONATAL RAT)
University of Nebraska

Curated by PDSP Ki Database
LigandPNGBDBM81808(CAS_133816 | NSC_133816 | WY 26392)
Show SMILES CCCS(=O)(=O)N(C)C1CCN2CCc3ccccc3C2C1
Show InChI InChI=1S/C17H26N2O2S/c1-3-12-22(20,21)18(2)15-9-11-19-10-8-14-6-4-5-7-16(14)17(19)13-15/h4-7,15,17H,3,8-13H2,1-2H3
Affinity DataKi:  1.90nMMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAlpha-2A adrenergic receptor(Homo sapiens (Human))
University of Nebraska

Curated by PDSP Ki Database
LigandPNGBDBM81808(CAS_133816 | NSC_133816 | WY 26392)
Show SMILES CCCS(=O)(=O)N(C)C1CCN2CCc3ccccc3C2C1
Show InChI InChI=1S/C17H26N2O2S/c1-3-12-22(20,21)18(2)15-9-11-19-10-8-14-6-4-5-7-16(14)17(19)13-15/h4-7,15,17H,3,8-13H2,1-2H3
Affinity DataKi:  2.20nMMore data for this Ligand-Target Pair
In DepthDetails PubMed