cyclopropylmethylscopolamine Report issue

Small molecule Experimental
AACT ChEMBL DrugBank Drug Central KEGG MeSH PubChem

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Chemistry

Mol. Mass

358.46

ALogP

1.84

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: C[N+]1(CC2CC2)[C@@H]2C[C@@H](OC(=O)[C@H](CO)c3ccccc3)C[C@H]1[C@@H]1O[C@@H]12
  • InChIKey: QVVOZYKELHAIPX-WVHCHWADSA-N
    InChI=1S/C21H28NO4/c1-22(11-13-7-8-13)17-9-15(10-18(22)20-19(17)26-20)25-21(24)16(12-23)14-5-3-2-4-6-14/h2-6,13,15-20,23H,7-12H2,1H3/q+1/t15-,16-,17-,18+,19-,20+,22?/m1/s1
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2110773   ChEMBL
cimetropium *

CHEMBL2105977   ChEMBL
cimetropium bromide

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