Ligand Data

Ligand

id 105385
Name CHEMBL311018
SMILES CCCOC(=O)NS(=O)(=O)c1ccccc1-c1ccc(Cn2c(CCC)nc(CC)c2C(=O)OCc2cccc(C(=O)c3ccccc3)c2)c(F)c1
InChIKey PBMSATXCNSGHNA-UHFFFAOYSA-N
Type small-molecule
External Links

Structure

Properties

Hydrogen bond acceptors 9
Hydrogen bond donors 1
Rotatable bonds 15
Molecular weight 725.3


Bioactivity

Receptor Affinity (nM) Potency (nM)
GTP Uniprot Species Family Class Min Avg Max Min Avg Max
AT1 AGTR1 Human Angiotensin A (Rhodopsin) 0.3 0.3 0.3
AT2 AGTR2 Human Angiotensin A (Rhodopsin) 10.0 10.0 10.0