phencynonate Report issue

Small molecule Experimental
AACT MeSH PubChem

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Chemistry

Mol. Mass

357.49

ALogP

3.34

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CN1CC2CCCC(C1)C2OC(=O)C(O)(c1ccccc1)C1CCCC1
  • InChIKey: ROZOEEGFKDFEFP-UHFFFAOYSA-N
    InChI=1S/C22H31NO3/c1-23-14-16-8-7-9-17(15-23)20(16)26-21(24)22(25,19-12-5-6-13-19)18-10-3-2-4-11-18/h2-4,10-11,16-17,19-20,25H,5-9,12-15H2,1H3
  • Chirality: Racemic Mixture
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4299850   ChEMBL
phencynonate

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