apabetalone Report issue

Small molecule Experimental
AACT DrugBank MeSH PubChem

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Chemistry

Mol. Mass

370.41

ALogP

2.6

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: COc1cc(OC)c2c(=O)[nH]c(-c3cc(C)c(OCCO)c(C)c3)nc2c1
  • InChIKey: NETXMUIMUZJUTB-UHFFFAOYSA-N
    InChI=1S/C20H22N2O5/c1-11-7-13(8-12(2)18(11)27-6-5-23)19-21-15-9-14(25-3)10-16(26-4)17(15)20(24)22-19/h7-10,23H,5-6H2,1-4H3,(H,21,22,24)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2393130   ChEMBL
apabetalone *

Apabetalone   Wikipedia

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