deucravacitinib (Sotkyktu) Report issue

Small molecule Approved FDA First in Class

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Chemistry

Mol. Mass

425.47

ALogP

1.73

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: [2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC
  • InChIKey: BZZKEPGENYLQSC-FIBGUPNXSA-N
    InChI=1S/C20H22N8O3/c1-21-20(30)16-14(9-15(25-26-16)24-19(29)11-7-8-11)23-13-6-4-5-12(17(13)31-3)18-22-10-28(2)27-18/h4-6,9-11H,7-8H2,1-3H3,(H,21,30)(H2,23,24,25,29)/i1D3
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4435170   ChEMBL
deucravacitinib

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