Details of the Drug Inactive Ingredient (DIG)

General Information of DIG (ID: E0B6RA)
DIG Name
Aminobenzoate sodium
Synonyms    Click to Show/Hide the Synonyms of This DIG
Sodium 4-aminobenzoate; 555-06-6; Aminobenzoate sodium; 4-Aminobenzoic acid sodium salt; Sodium p-aminobenzoate; Sodium aminobenzoate; Benzoic acid, 4-amino-, monosodium salt; Antergyl; UNII-75UI7QUZ5J; 4-aminobenzoic acid sodium; 75UI7QUZ5J; 4-Aminobenzoic acid, sodium salt; MFCD00064395; Pabavit; Benzoic acid, 4-amino-, sodium salt (1:1); Monosodium 4-aminobenzoate; CHEMBL1762658; p-Aminobenzoic acid, sodium salt; sodium;4-aminobenzoate; Sodium para-aminobenzoate; EINECS 209-080-3; Benzoic acid, p-amino-, monosodium salt; AI3-16691; Benzoic acid, 4-amino-, sodium salt; sodium 4-azanylbenzoate; ACMC-209lnd; EC 209-080-3; Aminobenzoate sodium (USP); SCHEMBL587865; 4-Aminobenzoic acid sodium sal; DTXSID8060296; 4-AMINOBENZOICACIDSODIUMSALT; ANW-32327; Benzoic acid, p-amino-, sodium salt; 4-Aminobenzoic acid sodium saltpowder; AKOS003051697; AKOS015888388; AKOS015950610; AKOS024272189; MP-2239; 54287-22-8; AK116649; AS-57673; DB-052748; A0276; FT-0617562; Z4878; D02907; A830682; W-105558; Q27266411
DIG Function
Lubricant
PubChem CID
517441
Formula
C7H6NNaO2
Canonical SMILES
C1=CC(=CC=C1C(=O)[O-])N.[Na+]
InChI
1S/C7H7NO2.Na/c8-6-3-1-5(2-4-6)7(9)10;/h1-4H,8H2,(H,9,10);/q;+1/p-1
InChIKey
XETSAYZRDCRPJY-UHFFFAOYSA-M
   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=517441"></iframe>
3D MOL is not available 2D MOL
Physicochemical Properties Molecular Weight 159.12 Topological Polar Surface Area 66.2
XlogP N.A. Complexity 132
Heavy Atom Count 11 Rotatable Bond Count 1
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3
Full List of Active Pharmaceutical Ingredients (APIs) Co-administrated with This DIG
       ICD Disease Classification 06 Mental/behavioural/neurodevelopmental disorder Click to Show/Hide
Methamphetamine
 API Info
Attention deficit hyperactivity disorder [ICD-11: 6A05]
 [1]
Full List of Biological Targets of DIG (DBTs) Regulated by This DIG
      Lyase/isomerase/ligase (L/I/G)
            DBT Name: Carbonic anhydrase I (CA1) 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 Ki = 8400 nM (tested by experiment) [2]
                    Tested Species Homo sapiens (Human)
                    UniProt ID CAH1_HUMAN
            DBT Name: Carbonic anhydrase II (CA2) 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 Ki = 8130 nM (tested by experiment) [2]
                    Tested Species Homo sapiens (Human)
                    UniProt ID CAH2_HUMAN
References
1 FDA label for approved methamphetamine from the official website of the U.S. Food and Drug Administration.
2 Carbonic anhydrase inhibitors. Inhibition of the -class enzymes from the fungal pathogens Candida albicans and Cryptococcus neoformans with branched aliphatic/aromatic carboxylates and their derivatives. Bioorg Med Chem Lett. 2011 Apr 15; 21(8):2521-6.

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