(2R,3R)-APDC   Click here for help

GtoPdb Ligand ID: 1392

Synonyms: (2R,4R)-APDC | LY314593
PDB Ligand
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 2
Topological polar surface area 112.65
Molecular weight 174.06
XLogP -3.88
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES OC(=O)C1NCC(C1)(N)C(=O)O
Isomeric SMILES OC(=O)[C@@H]1NC[C@@](C1)(N)C(=O)O
InChI InChI=1S/C6H10N2O4/c7-6(5(11)12)1-3(4(9)10)8-2-6/h3,8H,1-2,7H2,(H,9,10)(H,11,12)/t3-,6-/m1/s1
InChI Key XZFMJVJDSYRWDQ-AWFVSMACSA-N
Selectivity at GPCRs
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
mGlu3 receptor Hs Agonist Full agonist 5.3 pKi - 1
pKi 5.3 [1]
mGlu2 receptor Hs Agonist Full agonist 5.0 pKi - 1
pKi 5.0 [1]
Ligand mentioned in the following text fields