altropane Report issue

Small molecule Experimental
AACT DrugBank Drug Central MeSH PubChem

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Chemistry

Mol. Mass

429.27

ALogP

3.88

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: COC(=O)[C@H]1[C@@H](c2ccc(F)cc2)C[C@@H]2CC[C@H]1N2C/C=C/I
  • InChIKey: GTQLIPQFXVKRKJ-UNSMHXHVSA-N
    InChI=1S/C18H21FINO2/c1-23-18(22)17-15(12-3-5-13(19)6-4-12)11-14-7-8-16(17)21(14)10-2-9-20/h2-6,9,14-17H,7-8,10-11H2,1H3/b9-2+/t14-,15+,16+,17-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4301492   ChEMBL
altropane

Altropane   Wikipedia

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