BDBM50285135 (S)-3-{(S)-2-[(R)-2-Acetylamino-2-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-yl)-acetylamino]-propionylamino}-N-((1S,2S)-1-{(1S,2S)-1-[(S)-1-carboxy-2-(1H-indol-3-yl)-ethylcarbamoyl]-2-methyl-butylcarbamoyl}-2-methyl-butyl)-succinamic acid::CHEMBL433837

SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](NC(C)=O)C1c2ccccc2CCc2ccccc21)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC

InChI Key InChIKey=JABBSAWTMYXDMV-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50285135   

TargetEndothelin-1 receptor(Pig)
TBA

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50285135BDBM50285135((S)-3-{(S)-2-[(R)-2-Acetylamino-2-(10,11-dihydro-5...)
Affinity DataIC50: 6nMAssay Description:Antagonist activity against ET-A from porcine heart membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/25/2012
Entry Details Article