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Chemistry

Mol. Mass

400.98

ALogP

4.24

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: OCCN1CCN(CC\C=C\2/c3ccccc3Sc4ccc(Cl)cc24)CC1
  • InChIKey: WFPIAZLQTJBIFN-BLLMUTORSA-N
    InChI=1S/C22H25ClN2OS/c23-17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)27-22)5-3-9-24-10-12-25(13-11-24)14-15-26/h1-2,4-8,16,26H,3,9-15H2/b18-5+
  • Chirality: None
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL87385   ChEMBL
zuclopenthixol

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