tridihexethyl Report issue

Small molecule Approved FDA
ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem

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Chemistry

Mol. Mass

318.53

ALogP

4.72

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC[N+](CC)(CC)CCC(O)(C1CCCCC1)c2ccccc2
  • InChIKey: NPRHVSBSZMAEIN-UHFFFAOYSA-N
    InChI=1S/C21H36NO/c1-4-22(5-2,6-3)18-17-21(23,19-13-9-7-10-14-19)20-15-11-8-12-16-20/h7,9-10,13-14,20,23H,4-6,8,11-12,15-18H2,1-3H3/q+1
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1201354   ChEMBL
tridihexethyl *

CHEMBL1200771   ChEMBL
tridihexethyl chloride

CHEMBL2107686   ChEMBL
tridihexethyl iodide

7HE50A367X   NCATS
tridihexethyl *

Tridihexethyl   Wikipedia

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