CHEMBL512105


SMILES COCc1nnc(-c2cnc(-c3cccc(C#N)c3)cn2)n1-c1cccnc1
InChIKey WIEFPZPMUITQQG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 0
Rotatable bonds 5
Molecular weight (Da) 369.1

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
OT OXYR Human Vasopressin and oxytocin A pKi 7.08 7.08 7.08 ChEMBL
V1A V1AR Human Vasopressin and oxytocin A pKi 5.49 5.49 5.49 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database