etacrynic acid Report issue

Small molecule Approved FDA
AACT ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem repoDB

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Chemistry

Mol. Mass

303.14

ALogP

3.61

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCC(=C)C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl
  • InChIKey: AVOLMBLBETYQHX-UHFFFAOYSA-N
    InChI=1S/C13H12Cl2O4/c1-3-7(2)13(18)8-4-5-9(12(15)11(8)14)19-6-10(16)17/h4-5H,2-3,6H2,1H3,(H,16,17)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL456   ChEMBL
ethacrynic acid *

CHEMBL1200487   ChEMBL
ethacrynate sodium

M5DP350VZV   NCATS
ethacrynic acid *

Etacrynic acid   Wikipedia

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