oxtriphylline (choledyl) Report issue

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

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Chemistry

Mol. Mass

283.33

ALogP

-1.04

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: C[N+](C)(C)CCO.Cn1c(=O)c2[n-]cnc2n(C)c1=O
  • InChIKey: RLANKEDHRWMNRO-UHFFFAOYSA-M
    InChI=1S/C7H8N4O2.C5H14NO/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;1-6(2,3)4-5-7/h3H,1-2H3,(H,8,9,12);7H,4-5H2,1-3H3/q;+1/p-1
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1200434   ChEMBL
oxtriphylline

Choline theophyllinate   Wikipedia

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