BDBM50286239 CHEMBL315927::[(1S,4R,5R)-11-((S)-Isobutyl)-14-((R)-isopropyl)-8-naphthalen-1-ylmethyl-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](Cc2cccc3ccccc23)NC1=O)C(C)C

InChI Key InChIKey=VIKVVYZEMQCXCA-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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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 = 50286239   

TargetEndothelin-1 receptor(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50286239([(1S,4R,5R)-11-((S)-Isobutyl)-14-((R)-isopropyl)-8...)
Affinity DataKi:  224nMAssay Description:Affinity against ET A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/26/2012
Entry Details Article