CHEMBL269012


SMILES CN(C(=O)Cc1ccc(O)cc1)[C@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(N)=O
InChIKey SDDBZVPPXOIBKA-VUGWUCEWSA-N

Chemical properties

Hydrogen bond acceptors 14
Hydrogen bond donors 14
Rotatable bonds 32
Molecular weight (Da) 1126.6

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 8.57 8.57 8.57 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pKi 6.86 6.86 6.86 ChEMBL
V1A V1AR Human Vasopressin and oxytocin A pKi 10.1 10.1 10.1 ChEMBL
V1B V1BR Human Vasopressin and oxytocin A pKi 8.23 8.23 8.23 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database