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CHEBI:107914 - 2-(pyridin-4-ylmethylamino)benzoic acid

ChEBI IDCHEBI:107914
ChEBI Name2-(pyridin-4-ylmethylamino)benzoic acid
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DownloadsMolfile
FormulaC13H12N2O2
Net Charge0
Average Mass228.251
Monoisotopic Mass228.08988
SMILESO=C(O)c1ccccc1NCc1ccncc1
InChIInChI=1S/C13H12N2O2/c16-13(17)11-3-1-2-4-12(11)15-9-10-5-7-14-8-6-10/h1-8,15H,9H2,(H,16,17)
InChIKeyUPPNJZSFIIFBPQ-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-(pyridin-4-ylmethylamino)benzoic acid (CHEBI:107914) is a aminobenzoic acid (CHEBI:22495)
Manual XrefsDatabases
LSM-19291LINCS