[3H]glutamine   Click here for help

GtoPdb Ligand ID: 4634

Synonyms: [3H]-glutamine
PDB Ligand  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 5
Hydrogen bond donors 3
Rotatable bonds 4
Topological polar surface area 106.41
Molecular weight 146.07
XLogP -4.08
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Click here for help
Canonical SMILES NC(=O)CCC(C(=O)O)N
Isomeric SMILES NC(=O)CC[C@@H](C(=O)O)N
InChI InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1
InChI Key ZDXPYRJPNDTMRX-VKHMYHEASA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
(2S)-2-amino-4-carbamoylbutanoic acid
Synonyms Click here for help
[3H]-glutamine
Database Links Click here for help
ChEMBL Ligand CHEMBL930
DrugCentral Ligand 1311
GtoPdb PubChem SID 178101352
PubChem CID 5961
RCSB PDB Ligand GLN
Search Google for chemical match using the InChIKey ZDXPYRJPNDTMRX-VKHMYHEASA-N
Search Google for chemicals with the same backbone ZDXPYRJPNDTMRX
Search UniChem for chemical match using the InChIKey ZDXPYRJPNDTMRX-VKHMYHEASA-N
Search UniChem for chemicals with the same backbone ZDXPYRJPNDTMRX