CHEMBL52813


SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCN2C1=O
InChIKey HXGGOWUTOKFJEM-NSTWBPGMSA-N

Chemical properties

Hydrogen bond acceptors None
Hydrogen bond donors None
Rotatable bonds None
Molecular weight (Da)

Drug properties

Molecular type Protein
Physiological/Surrogate Surrogate
Approved drug No

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
V2 V2R Rat Vasopressin and oxytocin A pKi 4.48 4.48 4.48 ChEMBL
OT OXYR Rat Vasopressin and oxytocin A pKi 5.85 5.85 5.85 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
V1A V1AR Rat Vasopressin and oxytocin A pIC50 5.48 5.48 5.48 ChEMBL
V2 V2R Rat Vasopressin and oxytocin A pIC50 4.09 4.09 4.09 ChEMBL
OT OXYR Rat Vasopressin and oxytocin A pIC50 5.47 5.47 5.47 ChEMBL