Details of the Drug Inactive Ingredient (DIG)

General Information of DIG (ID: E0PP0G)
DIG Name
Aluminum hydroxide-glycine
Synonyms    Click to Show/Hide the Synonyms of This DIG
aluminum hydroxide-glycine (2:1); UNII-E9L1NA800E; E9L1NA800E; Q27277045
DIG Function
Other agent
PubChem CID
73415786
Formula
C2H11Al2NO8
Canonical SMILES
C(C(=O)O)N.[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Al+3].[Al+3]
InChI
1S/C2H5NO2.2Al.6H2O/c3-1-2(4)5;;;;;;;;/h1,3H2,(H,4,5);;;6*1H2/q;2*+3;;;;;;/p-6
InChIKey
IEDTVAKYAQVPRQ-UHFFFAOYSA-H
   Click to Show/Hide the Molecular Data (Structure/Property) of This DIG
Structure
<iframe style="width: 300px; height: 300px;" frameborder="0" src="https://embed.molview.org/v1/?mode=balls&cid=73415786"></iframe>
3D MOL is not available 2D MOL
Physicochemical Properties Molecular Weight 231.07 Topological Polar Surface Area 69.3
XlogP N.A. Complexity 42.9
Heavy Atom Count 13 Rotatable Bond Count 1
Hydrogen Bond Donor Count 8 Hydrogen Bond Acceptor Count 9
Full List of Active Pharmaceutical Ingredients (APIs) Co-administrated with This DIG
       ICD Disease Classification 11 Circulatory system disease Click to Show/Hide
Warfarin
 API Info
Atrial fibrillation [ICD-11: BC81]
 [1]
Full List of Biological Targets of DIG (DBTs) Regulated by This DIG
      G-protein coupled receptor (GPCR)
            DBT Name: Olfactory receptor 51E2 (OR51E2) Click to Show/Hide
               Detailed Information DBT Info click to show the detail info of this DBT
               Experiment for Assessing the Biological Activity of the Studied DIG on This DBT
                    Biological Activity EC50 = 58 nM (estimated based on the structural similarity with CHEMBL773 ) [2]
                    Structural Similarity Tanimoto coefficient = 0.870967742
                    Tested Species Homo sapiens (Human)
                    UniProt ID O51E2_HUMAN
References
1 FDA label for approved warfarin from the official website of the U.S. Food and Drug Administration.
2 US patent application no. 20180116992A1, Modulators of Prostate-Specific G-Protein Receptor (PSGR/OR51E2) and Methods of Using Same.

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