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Small molecule Experimental
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Chemistry

Mol. Mass

544.58

ALogP

5.92

Rule of 5

No

Rule of 3

No
Details
  • SMILES: C[C@]12C[C@H](c3ccc(S(C)(=O)=O)cc3)C3=C4CCC(=O)C=C4CC[C@H]3[C@@H]1CC[C@@]2(O)C(F)(F)C(F)(F)F
  • InChIKey: JUFWQQVHQFDUOD-ANRPBIDPSA-N
    InChI=1S/C27H29F5O4S/c1-24-14-21(15-3-7-18(8-4-15)37(2,35)36)23-19-10-6-17(33)13-16(19)5-9-20(23)22(24)11-12-25(24,34)26(28,29)27(30,31)32/h3-4,7-8,13,20-22,34H,5-6,9-12,14H2,1-2H3/t20-,21+,22-,24-,25-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3989936   ChEMBL
vilaprisan

Vilaprisan   Wikipedia

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