CHEMBL4205046


SMILES Cc1ccn(C(=O)Nc2ccc(C(=O)N3CCCCc4ccccc43)c(Cl)c2)n1
InChIKey WLSCYTZXIQSDLZ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 2
Molecular weight (Da) 408.1

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
OT OXYR Human Vasopressin and oxytocin A pKi 6.49 6.49 6.49 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pKi 7.42 7.42 7.42 ChEMBL
V1A V1AR Human Vasopressin and oxytocin A pKi 6.62 6.62 6.62 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
OT OXYR Human Vasopressin and oxytocin A pIC50 7.43 7.43 7.43 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pIC50 7.89 7.89 7.89 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pEC50 8.4 8.4 8.4 ChEMBL
V1A V1AR Human Vasopressin and oxytocin A pIC50 7.72 7.72 7.72 ChEMBL