iperoxo


SMILES C[N+](CC#CCOC1=NOCC1)(C)C
InChIKey WXXOCGISBCTWPW-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 2
Molecular weight (Da) 197.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Structure pdb 4MQS 4MQT 6OIJ 6OIK 7V68 8E9Z 8EA0 7TRQ 7TRK 7TRP

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
V1A V1AR Human Vasopressin and oxytocin A pKi 10.22 10.22 10.22 ChEMBL
V2 V2R Human Vasopressin and oxytocin A pKi 6.32 6.32 6.32 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database