BDBM50286244 CHEMBL87296::[(1S,4R,5R)-8-Benzyl-11-((S)-isobutyl)-14-((R)-isopropyl)-4,7,10,13,16-pentaoxo-hexadecahydro-3a,6,9,12,15-pentaaza-cyclopentacyclopentadecen-5-yl]-acetic acid

SMILES CC(C)C[C@@H]1NC(=O)[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](Cc2ccccc2)NC1=O)C(C)C

InChI Key InChIKey=ZNQOPZHWWHVGAE-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50286244   

TargetEndothelin-1 receptor(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50286244([(1S,4R,5R)-8-Benzyl-11-((S)-isobutyl)-14-((R)-iso...)
Affinity DataKi:  2.40E+3nMAssay Description:Affinity against ET A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/26/2012
Entry Details Article