L-372662


SMILES COc1cc(ccc1C(=O)N1CCC(CC1)N1C(=O)OCc2c1cccc2)OC1CCN(CC1)Cc1ccc[n+](c1C)[O-]
InChIKey SKWSXDUHUVMPBT-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 7
Molecular weight (Da) 586.3

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
OT OXYR Human Vasopressin and oxytocin A pKi 8.4 8.4 8.4 Guide to Pharmacology
V1A V1AR Rat Vasopressin and oxytocin A pKi 9.12 9.12 9.12 ChEMBL
V2 V2R Rat Vasopressin and oxytocin A pKi 5.01 5.01 5.01 ChEMBL
OT OXYR Rat Vasopressin and oxytocin A pKi 7.82 7.83 7.85 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pKi 4.55 4.55 4.55 ChEMBL
OT OXYR Human Vasopressin and oxytocin A pKi 8.31 8.35 8.39 ChEMBL
V1A V1AR Human Vasopressin and oxytocin A pKi 5.5 5.5 5.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database