iodoxamate meglumine (cholovue) Report issue

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

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Chemistry

Mol. Mass

1680.37

ALogP

Missing data

Rule of 5

Missing data

Rule of 3

Missing data
Details
  • SMILES: CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.OC(CCOCCOCCOCCOCCC(=O)Nc1c(I)cc(I)c(C(=O)O)c1I)Nc2c(I)cc(I)c(C(=O)O)c2I
  • InChIKey: CRNOLSVTUHZZTH-VRWDCWMNSA-N
    InChI=1S/C26H28I6N2O10.2C7H17NO5/c27-13-11-15(29)23(21(31)19(13)25(37)38)33-17(35)1-3-41-5-7-43-9-10-44-8-6-42-4-2-18(36)34-24-16(30)12-14(28)20(22(24)32)26(39)40;2*1-8-2-4(10)6(12)7(13)5(11)3-9/h11-12,17,33,35H,1-10H2,(H,34,36)(H,37,38)(H,39,40);2*4-13H,2-3H2,1H3/t;2*4-,5+,6+,7+/m.00/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3989524   ChEMBL
iodoxamate meglumine *

CHEMBL1200669   ChEMBL

CHEMBL1201324   ChEMBL
iodoxamate

CHEMBL1615487   ChEMBL
iodoxamic acid

CHEMBL4594231   ChEMBL
iodoxamate meglumine

NS1Y283HW4   NCATS
iodoxamic acid *

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