4-Aminopyridine-2,3-dicarboxylic acid

Details

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Internal ID cb2ab2d7-3d2b-4474-8b37-aaef06e15ef9
Taxonomy Organoheterocyclic compounds > Pyridines and derivatives > Pyridinecarboxylic acids and derivatives > Pyridinecarboxylic acids
IUPAC Name 4-aminopyridine-2,3-dicarboxylic acid
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C7H6N2O4/c8-3-1-2-9-5(7(12)13)4(3)6(10)11/h1-2H,(H2,8,9)(H,10,11)(H,12,13)
InChI Key BOUSAKJYINGFSA-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C7H6N2O4
Molecular Weight 182.13 g/mol
Exact Mass 182.03275668 g/mol
Topological Polar Surface Area (TPSA) 114.00 Ų
XlogP 0.10

Synonyms

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122475-55-2
4-Amino-2,3-pyridinedicarboxylic acid
SCHEMBL1243693
SCHEMBL29860445
BOUSAKJYINGFSA-UHFFFAOYSA-N
AB76521
DB-412207

2D Structure

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2D Structure of 4-Aminopyridine-2,3-dicarboxylic acid

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL4040 P28482 MAP kinase ERK2 96.50% 83.82%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 93.59% 96.09%
CHEMBL1293249 Q13887 Kruppel-like factor 5 80.29% 86.33%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 14282693
LOTUS LTS0055219
wikiData Q104940699