5-HEAT


SMILES OCCOc1ccc2c(c1)c(CCNC(=O)C)c[nH]2
InChIKey CZPLTTWZQPLXMQ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 3
Rotatable bonds 6
Molecular weight (Da) 262.1

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
MT1 MTR1A Human Melatonin A pKi 7.8 7.8 7.8 Guide to Pharmacology
MT2 MTR1B Human Melatonin A pKi 7.1 7.1 7.1 Guide to Pharmacology
MT1 MTR1A Human Melatonin A pKi 7.77 7.77 7.77 ChEMBL
MT2 MTR1B Human Melatonin A pKi 7.12 7.12 7.12 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database