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Chemical structure of VU 0155041 sodium salt

GC14003

VU 0155041 sodium salt

Also known as sodium cis-(1R,2S)-2-[(3,5-dichlorophenyl)carbamoyl]cyclohexane-1-carboxylate

VU 0155041 sodium salt is a potent, selective positive allosteric modulator (PAM) of mGluR4, with EC50s of 798 nM and 693 nM for human and rat mGluR4, respectively

ChemicalCAS1259372-69-4MW338.16FormulaC14H14Cl2NNaO3
CAS number
1259372-69-4
Molecular weight
338.16
Formula
C14H14Cl2NNaO3
Solubility
DMSO: 1 mg/ml,PBS (pH 7·2): 2 mg/ml
InChIKey
ZFDOLOCYGVTGDQ-ZVWHLABXSA-M
Catalogue number
GC14003
Brand
GLPBIO
Computed properties PubChem CID 56972207 · TPSA 69.2 Ų · H-bond donors 1 · H-bond acceptors 3
TPSA
69.2 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21

SMILES C1CC[C@H]([C@H](C1)C(=O)NC2=CC(=CC(=C2)Cl)Cl)C(=O)[O-].[Na+]

Computed descriptors from PubChem (CID 56972207), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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