betaine   Click here for help

GtoPdb Ligand ID: 4550

Synonyms: glycine betaine | N,N,N-trimethylammonioacetate | trimethylglycine
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 2
Topological polar surface area 40.13
Molecular weight 117.08
XLogP -1.23
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES [O-]C(=O)C[N+](C)(C)C
Isomeric SMILES [O-]C(=O)C[N+](C)(C)C
InChI InChI=1S/C5H11NO2/c1-6(2,3)4-5(7)8/h4H2,1-3H3
InChI Key KWIUHFFTVRNATP-UHFFFAOYSA-N
Transporters Moving this Compound Across a Lipid Membrane
Transporter EC number Reaction Reference
BGT1
Proton-coupled Amino acid Transporter 1 1