Cedirogant Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

547.79

ALogP

7.0

Rule of 5

No

Rule of 3

No
Details
  • SMILES: O=C(O)CC1CCN(C(=O)c2ccc(Cl)c(Cn3ccc4cc(C(F)(F)F)cc(Cl)c43)c2Cl)CC1
  • InChIKey: MNEOHCYSHVKLIC-UHFFFAOYSA-N
    InChI=1S/C24H20Cl3F3N2O3/c25-18-2-1-16(23(35)31-6-3-13(4-7-31)9-20(33)34)21(27)17(18)12-32-8-5-14-10-15(24(28,29)30)11-19(26)22(14)32/h1-2,5,8,10-11,13H,3-4,6-7,9,12H2,(H,33,34)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL5095174   ChEMBL
cedirogant

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