valethamate bromide Report issue

Small molecule Experimental
ChEMBL Drug Central KEGG MeSH PubChem

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Chemistry

Mol. Mass

306.47

ALogP

3.85

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCC(C)C(C(=O)OCC[N+](C)(CC)CC)c1ccccc1
  • InChIKey: UPPMZCXMQRVMME-UHFFFAOYSA-N
    InChI=1S/C19H32NO2/c1-6-16(4)18(17-12-10-9-11-13-17)19(21)22-15-14-20(5,7-2)8-3/h9-13,16,18H,6-8,14-15H2,1-5H3/q+1
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2111176   ChEMBL
valethamate *

CHEMBL2107687   ChEMBL
valethamate bromide

D64S64QVX7   NCATS
valethamate *

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