Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

565 - Overview - Compound Synopsis

Synonyms
EAAETACRYNIC ACID
ETHACRYNIC ACIDEdecrin
Etacrynic AcidEthacrynic Acid
Ethacrynic acidHydromedin
MK-595Reomax
Molecular Formula
C13H12Cl2O4
InChI
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)
Smiles
C=C(CC)C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl
Cross References
UniChem211388
canSAR565
PDBe (Protein Data Bank Europe)EAA
ChEMBLCHEMBL456
BindingDB50186231
Commercially Available
Yes
Protein Targets


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 302.0112642243.60571431Yes


Compound Lineages


Dosed Drug / Tested Compound(s)Free Compound Form(s)Active Form(s)





Dosed Drug / Tested Compound(s)Free Compound Form(s)Active Form(s)