glycine   Click here for help

GtoPdb Ligand ID: 727

PDB Ligand
Compound class: Metabolite
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 1
Topological polar surface area 63.32
Molecular weight 75.03
XLogP -3.35
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES NCC(=O)O
Isomeric SMILES NCC(=O)O
InChI InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)
InChI Key DHMQDGOQFOQNFH-UHFFFAOYSA-N
Classification Click here for help
Compound class Metabolite
IUPAC Name Click here for help
carbonocyanidic acid
International Nonproprietary Names Click here for help
INN number INN
630 glycine
Database Links Click here for help
Specialist databases
GPCRdb Ligand glycine
Other databases
CAS Registry No. 56-40-6 (source: Scifinder)
ChEBI CHEBI:15428
ChEMBL Ligand CHEMBL773
DrugBank Ligand DB00145
DrugCentral Ligand 1319
GtoPdb PubChem SID 135651492
PubChem CID 750
RCSB PDB Ligand GLY
Search Google for chemical match using the InChIKey DHMQDGOQFOQNFH-UHFFFAOYSA-N
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Search PubMed clinical trials glycine
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UniChem Compound Search for chemical match using the InChIKey DHMQDGOQFOQNFH-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey DHMQDGOQFOQNFH-UHFFFAOYSA-N
Wikipedia Glycine

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Tocris
Glycine (links to external site)
Cat. No. 0219