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Small molecule Experimental
AACT

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Chemistry

Mol. Mass

512.43

ALogP

3.84

Rule of 5

No

Rule of 3

No
Details
  • SMILES: C[C@@H](Oc1ccc(S(C)(=O)=O)cc1C(=O)N1C[C@@H]2C[C@]2(c2cc(C(F)(F)F)on2)C1)C(F)(F)F
  • InChIKey: MYHDQTVHHMSLEF-DDBGAENHSA-N
    InChI=1S/C20H18F6N2O5S/c1-10(19(21,22)23)32-14-4-3-12(34(2,30)31)5-13(14)17(29)28-8-11-7-18(11,9-28)15-6-16(33-27-15)20(24,25)26/h3-6,10-11H,7-9H2,1-2H3/t10-,11+,18+/m1/s1
  • Chirality: None
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL5314576   ChEMBL
iclepertin

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