BDBM50008084 1-[13-Benzyl-7-carbamoylmethyl-10-isopropyl-16-(4-nitro-benzyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaaza-cycloicosane-4-carbonyl]-pyrrolidine-2-carboxylic acid {5-amino-1-[1-carbamoyl-2-(4-hydroxy-phenyl)-ethylcarbamoyl]-pentyl}-amide::CHEMBL2372417

SMILES [#7]-[#6@H]-1-[#6]-[#16]-[#16]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(cc2)-[#7+](-[#8-])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6]-1=O)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6]-[#6](-[#7])=O

InChI Key InChIKey=XXMFGYSWVADIPC-UHFFFAOYSA-N

Data  2 Kd

  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 2 hits for monomerid = 50008084   

TargetVasopressin V1a receptor(Rat)
University of Sherbrooke

Curated by ChEMBL
LigandPNGBDBM50008084(1-[13-Benzyl-7-carbamoylmethyl-10-isopropyl-16-(4-...)
Affinity DataKd:  41nMAssay Description:Negative log of Kd for Vasopressin V1 receptorMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetVasopressin V1a receptor(Rat)
University of Sherbrooke

Curated by ChEMBL
LigandPNGBDBM50008084(1-[13-Benzyl-7-carbamoylmethyl-10-isopropyl-16-(4-...)
Affinity DataKd:  41nMAssay Description:Binding potency against Vasopressin V1 receptor in rat liver cells.More data for this Ligand-Target Pair
In DepthDetails Article
PubMed