iocetamic acid (cholebrine) Report issue

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

Back

Chemistry

Mol. Mass

613.9566

ALogP

3.16

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CC(CN(C(C)=O)C1=C(I)C=C(I)C(N)=C1I)C(O)=O
  • InChIKey: GSVQIUGOUKJHRC-UHFFFAOYSA-N
    1S/C12H13I3N2O3/c1-5(12(19)20)4-17(6(2)18)11-8(14)3-7(13)10(16)9(11)15/h3,5H,4,16H2,1-2H3,(H,19,20)
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1200770   ChEMBL
iocetamic acid

FA675Q0E3E   NCATS
iocetamic acid *

Iocetamic acid   Wikipedia

Feedback

Data collection and curation is an ongoing process for CDEK - if you notice any information here to be missing or incorrect, please let us know! When possible, please include a source URL (we verify all data prior to inclusion).

Report issue