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Chemistry

Mol. Mass

397.52

ALogP

4.93

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCOc1ccc(\C=C\2/NCCc3cc(OCC)c(OCC)cc23)cc1OCC
  • InChIKey: OMFNSKIUKYOYRG-MOSHPQCFSA-N
    InChI=1S/C24H31NO4/c1-5-26-21-10-9-17(14-22(21)27-6-2)13-20-19-16-24(29-8-4)23(28-7-3)15-18(19)11-12-25-20/h9-10,13-16,25H,5-8,11-12H2,1-4H3/b20-13-
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL551978   ChEMBL
drotaverine

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