sotagliflozin   Click here for help

GtoPdb Ligand ID: 8312

Synonyms: Inpefa® | LX-4211 | LX4211 | Zynquista®
Approved drug
sotagliflozin is an approved drug (EMA (2019), FDA (2023))
Compound class: Synthetic organic
Comment: Sotagliflozin is a dual inhibitor of the sodium/glucose cotransporters 1 and 2 (SGLT1/2) [5,8]. SGLT1 and SGLT2 mediate glucose reabsorption, by the kidney and in the gastrointestinal tract respectively.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 6
Topological polar surface area 104.45
Molecular weight 424.11
XLogP 3.9
No. Lipinski's rules broken 0
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Canonical SMILES CCOc1ccc(cc1)Cc1cc(ccc1Cl)C1OC(SC)C(C(C1O)O)O
Isomeric SMILES CCOc1ccc(cc1)Cc1cc(ccc1Cl)[C@@H]1O[C@H](SC)[C@H]([C@@H]([C@H]1O)O)O
InChI 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
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (EMA (2019), FDA (2023))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
9824 sotagliflozin
Synonyms Click here for help
Inpefa® | LX-4211 | LX4211 | Zynquista®
Database Links Click here for help
CAS Registry No. 1018899-04-1
ChEMBL Ligand CHEMBL3039507
DrugCentral Ligand 5339
GtoPdb PubChem SID 252166524
PubChem CID 24831714
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UniChem Compound Search for chemical match using the InChIKey QKDRXGFQVGOQKS-CRSSMBPESA-N
UniChem Connectivity Search for chemical match using the InChIKey QKDRXGFQVGOQKS-CRSSMBPESA-N