CHEMBL24526


SMILES CC(=O)N1CCC(Oc2ccc(CC(=O)N3CCC(N4C(=O)OCc5ccccc54)CC3)c(OCC(F)(F)F)c2)CC1
InChIKey VGSQHYIAUDIJTE-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 7
Molecular weight (Da) 589.2

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
V1A V1AR Rat Vasopressin and oxytocin A pKi 8.7 8.7 8.7 ChEMBL
V2 V2R Rat Vasopressin and oxytocin A pKi 6.82 6.82 6.82 ChEMBL
OT OXYR Rat Vasopressin and oxytocin A pKi 9.15 9.15 9.15 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pKi 6.89 6.89 6.89 ChEMBL
OT OXYR Human Vasopressin and oxytocin A pKi 8.85 8.85 8.85 ChEMBL
V1A V1AR Human Vasopressin and oxytocin A pKi 6.13 6.13 6.13 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database