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Small molecule Experimental

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Chemistry

Mol. Mass

456.42

ALogP

3.63

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC(=O)N1CCc2c(C(=O)N3CCC(c4ccc(F)c(F)c4C(F)(F)F)CC3)n[nH]c2C1
  • InChIKey: HAGSLCBZFRRBLS-UHFFFAOYSA-N
    InChI=1S/C21H21F5N4O2/c1-11(31)30-9-6-14-16(10-30)27-28-19(14)20(32)29-7-4-12(5-8-29)13-2-3-15(22)18(23)17(13)21(24,25)26/h2-3,12H,4-10H2,1H3,(H,27,28)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3967849   ChEMBL
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