propantheline bromide (pro-banthine) Report issue

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

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Chemistry

Mol. Mass

368.5

ALogP

4.73

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC(C)[N+](C)(CCOC(=O)C1c2ccccc2Oc2ccccc21)C(C)C
  • InChIKey: VVWYOYDLCMFIEM-UHFFFAOYSA-N
    InChI=1S/C23H30NO3/c1-16(2)24(5,17(3)4)14-15-26-23(25)22-18-10-6-8-12-20(18)27-21-13-9-7-11-19(21)22/h6-13,16-17,22H,14-15H2,1-5H3/q+1
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1180725   ChEMBL
propantheline *

CHEMBL1240   ChEMBL
propantheline bromide

1306V2B0Q8   NCATS
propantheline *

Propantheline bromide   Wikipedia

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