pf-04995274 Report issue

Small molecule Experimental
AACT DrugBank PubChem

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Chemistry

Mol. Mass

432.52

ALogP

2.63

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: OC1(CN2CCC(COc3noc4cccc(O[C@@H]5CCOC5)c34)CC2)CCOCC1
  • InChIKey: WLLOFQROROXOMO-GOSISDBHSA-N
    InChI=1S/C23H32N2O6/c26-23(7-12-27-13-8-23)16-25-9-4-17(5-10-25)14-29-22-21-19(30-18-6-11-28-15-18)2-1-3-20(21)31-24-22/h1-3,17-18,26H,4-16H2/t18-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2152922   ChEMBL
pf-04995274

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