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Chemistry

Mol. Mass

600.48

ALogP

8.2

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CCOC(=O)N1[C@H](CC)C[C@H](N(Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)C(=O)OC)c3cc(ccc13)C(F)(F)F
  • InChIKey: CMSGWTNRGKRWGS-NQIIRXRSSA-N
    InChI=1S/C26H25F9N2O4/c1-4-18-12-21(19-11-15(24(27,28)29)6-7-20(19)37(18)23(39)41-5-2)36(22(38)40-3)13-14-8-16(25(30,31)32)10-17(9-14)26(33,34)35/h6-11,18,21H,4-5,12-13H2,1-3H3/t18-,21+/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL479527   ChEMBL
torcetrapib

Torcetrapib   Wikipedia

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