Ligand Data

Ligand

id 109709
Name CHEMBL321561
SMILES Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N3C[C@@H]4C5CCC(C5)N4Cc4cc(Cl)ccc43)c(Cl)c2)cc1
InChIKey GUDPRPCHKQSPGM-JIUSLJTMSA-N
Type small-molecule
External Links

Structure

Properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight 595.2


Bioactivity

Receptor Affinity (nM) Potency (nM)
GTP Uniprot Species Family Class Min Avg Max Min Avg Max
V2 V2R Human Vasopressin and oxytocin A (Rhodopsin) 30.0 30.0 30.0
V1A V1AR Human Vasopressin and oxytocin A (Rhodopsin) 35.0 35.0 35.0