Molecular Identity
Amlexanox
2-amino-5-oxo-7-propan-2-ylchromeno[2,3-b]pyridine-3-carboxylic acid
PubChem CID: 2161
Amlexanox is a pyridochromene-derived monocarboxylic acid having an amino substituent at the 2-position, an oxo substituent at the 5-position and an isopropyl substituent at the 7-position. It has a role as a non-steroidal anti-inflammatory drug, an anti-ulcer drug and an anti-allergic agent. It is a monocarboxylic acid and a pyridochromene.
2D Structure
Properties
C16H14N2O4
Molecular Formula
298.29
Molecular Weight
g/mol
298.0954
Exact Mass
Da
3.1
XLogP
Drug-like (Lipinski: < 5)
103
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
6
H-Bond Acceptors
467
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)C1=CC2=C(C=C1)OC3=NC(=C(C=C3C2=O)C(=O)O)NIsomeric SMILES
SMILES: CC(C)C1=CC2=C(C=C1)OC3=NC(=C(C=C3C2=O)C(=O)O)NSynonyms(20)
amlexanox68302-57-8AmoxanoxAphthasolElicsAA-673AmlexanoxoAmlexanoxumaphthealCHX 3673CHX-3673AA 6732-amino-5-oxo-7-(propan-2-yl)-5H-chromeno[2,3-b]pyridine-3-carboxylic acid2-Amino-7-isopropyl-5-oxo-5H-(1)benzopyrano(2,3-b)pyridine-3-carboxylic acidBRL1C2459K
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Amlexanox
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