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Small molecule Experimental

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Chemistry

Mol. Mass

295.41

ALogP

3.67

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: O=C1Cc2ccccc2C(=C2CCNCC2)c2ccsc21
  • InChIKey: IYSYPCSSDZBWHN-UHFFFAOYSA-N
    InChI=1S/C18H17NOS/c20-16-11-13-3-1-2-4-14(13)17(12-5-8-19-9-6-12)15-7-10-21-18(15)16/h1-4,7,10,19H,5-6,8-9,11H2
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1197564   ChEMBL
norketotifen

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