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LY2812223

CAT: 0013-GTR19203608-02Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19203608-02Size:100 mg
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Description
LY2812223 is a potent and functionally selective agonist for the mGlu2 receptor, exhibiting high binding affinity for both mGlu2 and mGlu3 (Ki = 144 nM and 156 nM, respectively) . This research compound is utilized in vitro and in vivo to investigate the role of mGlu2/3 receptors in neurological disorders.
CAS Number
1311385-20-2
Field of Research
Cell Biology, Neuroscience
Smiles
[H][C@@]12[C@@H] (C[C@@] (N) (C (O) =O) [C@]1 ([H]) [C@@]2 ([H]) C (O) =O) Sc1nnc[nH]1
Molecular Formula
C10H12N4O4S
Molecular Weight
284.29
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

LY-2812223

a metabotropic glutamate receptor 2 agonist; structure in first source

CAS Number1311385-20-2
PubChem CID53240406
IUPAC Name(1R,2S,4R,5R,6R)-2-amino-4-(1H-1,2,4-triazol-5-ylsulfanyl)bicyclo[3.1.0]hexane-2,6-dicarboxylic acid
Molecular FormulaC10H12N4O4S
Molecular Weight284.29
XLogP-2.9
Topological Polar Surface Area167
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count19
Formal Charge0
Complexity436
SMILES
C1[C@H]([C@H]2[C@@H]([C@H]2[C@@]1(C(=O)O)N)C(=O)O)SC3=NC=NN3
InChI
InChI=1S/C10H12N4O4S/c11-10(8(17)18)1-3(19-9-12-2-13-14-9)4-5(6(4)10)7(15)16/h2-6H,1,11H2,(H,15,16)(H,17,18)(H,12,13,14)/t3-,4+,5+,6+,10+/m1/s1
InChIKey
YSOWRGMLMZQSBX-AVUIYAGVSA-N
Chemical Structure
2D Structure
2D structure of LY-2812223
CAS: 1311385-20-2
CID: 53240406
Formula: C10H12N4O4S
MW: 284.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight284.29
XLogP3-2.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass284.05792605
Monoisotopic Mass284.05792605
Topological Polar Surface Area167 Ų
Heavy Atom Count19
Formal Charge0
Complexity436
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BA5583-5LY2812223
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A21100-25LY2812223 25mg
A21100-1LY2812223 1mg
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A21100-10LY2812223 10mg
A21100-5LY2812223 5mg

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