melatonin

Ligand Id: 224
Ligand name melatonin
Abbreviated name MLT

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 54.12
Molecular weight 232.12
XLogP 1.34
No. Lipinski's rules broken 0

Molecular properties generated using the CDK


Classification
Compound class Metabolite or derivative
Approved drug? Yes (source: EMA (2005))
IUPAC Name
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
Database Links
CAS Registry No. 73-31-4
ChEBI CHEBI:16796
ChEMBL Ligand CHEMBL45
DrugBank Ligand DB01065
Human Metabolome Database HMDB01389
NURSA Ligand 10.1621/8DVWM6W3LN
PharmGKB Drug PA164752558
PubChem CID 896
RCSB PDB Ligand ML1
Search Google for chemical match using the InChIKey DRLFMBDRBRZALE-UHFFFAOYSA-N
Search Google for chemicals with the same backbone DRLFMBDRBRZALE
Wikipedia Melatonin