BDBM50080627 (2R,3R,4S)-4-Benzo[1,3]dioxol-5-yl-1-({[(2-ethyl-phenyl)-o-tolyl-methyl]-carbamoyl}-methyl)-2-[4-(2-isopropoxy-ethoxy)-phenyl]-pyrrolidine-3-carboxylic acid; TFA::CHEMBL123206

SMILES CCc1ccccc1C(NC(=O)CN1C[C@@H]([C@H]([C@@H]1c1ccc(OCCOC(C)C)cc1)C(O)=O)c1ccc2OCOc2c1)c1ccccc1C

InChI Key InChIKey=ITIIXFMHUJLFHC-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50080627   

TargetEndothelin receptor type B(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50080627((2R,3R,4S)-4-Benzo[1,3]dioxol-5-yl-1-({[(2-ethyl-p...)
Affinity DataIC50: 3.30nMAssay Description:Binding ability determined by the displacement of [125 I]ET-3 from the human Endothelin B receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetEndothelin-1 receptor(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50080627((2R,3R,4S)-4-Benzo[1,3]dioxol-5-yl-1-({[(2-ethyl-p...)
Affinity DataIC50: 1.43E+4nMAssay Description:Binding ability determined by the displacement of [125I]ET1 from the human endothelin A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed