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Chemistry

Mol. Mass

524.64

ALogP

5.31

Rule of 5

No

Rule of 3

No
Details
  • SMILES: Cc1cc(OCCCS(=O)(=O)C)cc(C)c1c2cccc(COc3ccc4[C@H](CC(=O)O)COc4c3)c2
  • InChIKey: BZCALJIHZVNMGJ-HSZRJFAPSA-N
    InChI=1S/C29H32O7S/c1-19-12-25(34-10-5-11-37(3,32)33)13-20(2)29(19)22-7-4-6-21(14-22)17-35-24-8-9-26-23(15-28(30)31)18-36-27(26)16-24/h4,6-9,12-14,16,23H,5,10-11,15,17-18H2,1-3H3,(H,30,31)/t23-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1829174   ChEMBL
fasiglifam

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