glycine   

GtoPdb Ligand ID: 727

2D Structure
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Physico-chemical Properties
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
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
Compound class Metabolite or derivative
IUPAC Name
carbonocyanidic acid
International Nonproprietary Names
INN number INN
630 glycine
Database Links
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 UniChem for chemical match using the InChIKey DHMQDGOQFOQNFH-UHFFFAOYSA-N
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Wikipedia Glycine

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Tocris
Glycine
Cat. No. 0219