CHEMBL4079699


SMILES CCNC(=S)NCCc1cccc2ccc(OC)nc12
InChIKey ICRWGHMRXPLABG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 289.1

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
MT2 MTR1B Human Melatonin A pKi 9.4 9.4 9.4 ChEMBL
MT1 MTR1A Human Melatonin A pKi 8.4 8.4 8.4 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 8.96 8.96 8.96 ChEMBL
MT1 MTR1A Human Melatonin A pEC50 7.51 7.51 7.51 ChEMBL