[3H]alanine   Click here for help

GtoPdb Ligand ID: 4543

Synonyms: [3H]-alanine
PDB Ligand  Ligand is labelled  Ligand is radioactive
Compound class: Synthetic organic
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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 89.05
XLogP -2.82
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CC(C(=O)O)N
Isomeric SMILES C[C@@H](C(=O)O)N
InChI InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1
InChI Key QNAYBMKLOCPYGJ-REOHCLBHSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
(2S)-2-aminopropanoic acid
Synonyms Click here for help
[3H]-alanine
Database Links Click here for help
ChEMBL Ligand CHEMBL279597
DrugCentral Ligand 4255
GtoPdb PubChem SID 178101264
PubChem CID 5950
RCSB PDB Ligand ALA
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Tocris
L-Alanine
Cat. No. 0205