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Chemistry

Mol. Mass

424.95

ALogP

3.17

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCOc1ccc(Cc2cc(ccc2Cl)[C@@H]3O[C@H](SC)[C@@H](O)[C@H](O)[C@H]3O)cc1
  • InChIKey: QKDRXGFQVGOQKS-CRSSMBPESA-N
    InChI=1S/C21H25ClO5S/c1-3-26-15-7-4-12(5-8-15)10-14-11-13(6-9-16(14)22)20-18(24)17(23)19(25)21(27-20)28-2/h4-9,11,17-21,23-25H,3,10H2,1-2H3/t17-,18-,19+,20+,21-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3039507   ChEMBL
sotagliflozin

Sotagliflozin   Wikipedia

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