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Chemistry

Mol. Mass

313.83

ALogP

3.98

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CN1CCc2cc(Cl)c(O)cc2[C@@H]3[C@@H]1CCc4ccccc34
  • InChIKey: DMJWENQHWZZWDF-PKOBYXMFSA-N
    InChI=1S/C19H20ClNO/c1-21-9-8-13-10-16(20)18(22)11-15(13)19-14-5-3-2-4-12(14)6-7-17(19)21/h2-5,10-11,17,19,22H,6-9H2,1H3/t17-,19+/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL298406   ChEMBL
ecopipam

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