trans-4-hydroxy-proline   Click here for help

GtoPdb Ligand ID: 4704

Synonyms: 4-hydroxyproline
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 4
Hydrogen bond donors 3
Rotatable bonds 1
Topological polar surface area 69.56
Molecular weight 131.06
XLogP -0.79
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES OC1CNC(C1)C(=O)O
Isomeric SMILES O[C@H]1CN[C@@H](C1)C(=O)O
InChI InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4+/m1/s1
InChI Key PMMYEEVYMWASQN-DMTCNVIQSA-N
References
1. Thwaites DT, Anderson CM. (2011)
The SLC36 family of proton-coupled amino acid transporters and their potential role in drug transport.
Br J Pharmacol, 164 (7): 1802-16. [PMID:21501141]