OPC-51803


SMILES CC(NC(=O)C[C@H]1CCCN(c2c1cccc2)C(=O)c1ccc(cc1Cl)N1CCCC1)C
InChIKey INGXCNVWWKKWOO-LJQANCHMSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 453.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
V1A V1AR Human Vasopressin and oxytocin A pKi 6.1 6.1 6.1 Guide to Pharmacology
V2 V2R Human Vasopressin and oxytocin A pKi 7.0 7.0 7.0 Guide to Pharmacology
V2 V2R Human Vasopressin and oxytocin A pKi 7.04 7.04 7.04 ChEMBL
V1A V1AR Human Vasopressin and oxytocin A pKi 6.09 6.09 6.09 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
V2 V2R Rat Vasopressin and oxytocin A pIC50 6.64 6.64 6.64 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pIC50 6.48 6.48 6.48 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pEC50 6.72 6.72 6.72 ChEMBL