benactyzine Report issue

Small molecule Experimental
ChEMBL DrugBank Drug Central KEGG MeSH PubChem

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Chemistry

Mol. Mass

327.4174

ALogP

2.81

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCN(CC)CCOC(=O)C(O)(C1=CC=CC=C1)C2=CC=CC=C2
  • InChIKey: IVQOFBKHQCTVQV-UHFFFAOYSA-N
    1S/C20H25NO3/c1-3-21(4-2)15-16-24-19(22)20(23,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,23H,3-4,15-16H2,1-2H3
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL70352   ChEMBL
benactyzine

595EG71R3F   NCATS
benactyzine *

Benactyzine   Wikipedia

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