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Small molecule Experimental

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Chemistry

Mol. Mass

376.5

ALogP

6.37

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CCOc1ccc(C(C)(C)COCc2cccc(Oc3ccccc3)c2)cc1
  • InChIKey: YREQHYQNNWYQCJ-UHFFFAOYSA-N
    InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2105573   ChEMBL
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