CHEMBL52755


SMILES COc1cc2c(CCNC(C)=O)c(I)[nH]c2cc1[N+](=O)[O-]
InChIKey XDXQGYQOFIFBMS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 403.0

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
MT2 MTR1B Human Melatonin A pKi 9.77 9.77 9.77 ChEMBL
MT1 MTR1A Human Melatonin A pKi 9.52 9.52 9.52 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database