CHEMBL2326200


SMILES CCC(=O)NCCCc1cc(OC)ccc1C#Cc1cccc(OC)c1
InChIKey ABJOHSLYSRTJAR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 351.2

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 10.14 10.14 10.14 ChEMBL
MT1 MTR1A Human Melatonin A pKi 7.42 7.42 7.42 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT2 MTR1B Human Melatonin A pEC50 9.96 9.96 9.96 ChEMBL
MT1 MTR1A Human Melatonin A pEC50 8.08 8.08 8.08 ChEMBL