CHEMBL86577


SMILES Cc1nnc(-c2ccc(-c3ccccc3)cc2)n1-c1ccccc1OCc1ccc(C(=O)N2CCN(C)CC2)cc1
InChIKey MEDYXWWEPBZLAH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 7
Molecular weight (Da) 543.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
V1A V1AR Rat Vasopressin and oxytocin A pKi 7.2 7.2 7.2 ChEMBL
V2 V2R Rat Vasopressin and oxytocin A pKi 6.44 6.44 6.44 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pKi 6.23 6.23 6.23 ChEMBL
V1A V1AR Human Vasopressin and oxytocin A pKi 8.52 8.52 8.52 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database