[3H]muscimol   Click here for help

GtoPdb Ligand ID: 4090

 Ligand is labelled  Ligand is radioactive
Compound class: Synthetic organic
Click here for help
2D Structure
Click here for help
Click here for structure editor
Physico-chemical Properties
Click here for help
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 72.02
Molecular weight 114.04
XLogP -1.1
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Click here for help
Canonical SMILES NCc1cc(=O)[nH]o1
Isomeric SMILES NCc1cc(=O)[nH]o1
InChI InChI=1S/C4H6N2O2/c5-2-3-1-4(7)6-8-3/h1H,2,5H2,(H,6,7)
InChI Key ZJQHPWUVQPJPQT-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
5-(aminomethyl)-2,3-dihydro-1,2-oxazol-3-one
Database Links Click here for help
ChEMBL Ligand CHEMBL273481
GtoPdb PubChem SID 178100913
PubChem CID 4266
Search Google for chemical match using the InChIKey ZJQHPWUVQPJPQT-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ZJQHPWUVQPJPQT
UniChem Compound Search for chemical match using the InChIKey ZJQHPWUVQPJPQT-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey ZJQHPWUVQPJPQT-UHFFFAOYSA-N

Product suppliers

View disclaimer

Tocris
Muscimol (links to external site)
Cat. No. 0289