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Chemistry

Mol. Mass

637.51

ALogP

9.76

Rule of 5

No

Rule of 3

No
Details
  • SMILES: COc1cc(F)c(cc1c2ccc(cc2CN3[C@@H](C)[C@H](OC3=O)c4cc(cc(c4)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(C)C
  • InChIKey: MZZLGJHLQGUVPN-HAWMADMCSA-N
    InChI=1S/C30H25F10NO3/c1-14(2)22-11-23(25(43-4)12-24(22)31)21-6-5-18(28(32,33)34)9-17(21)13-41-15(3)26(44-27(41)42)16-7-19(29(35,36)37)10-20(8-16)30(38,39)40/h5-12,14-15,26H,13H2,1-4H3/t15-,26-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1800807   ChEMBL
anacetrapib

Anacetrapib   Wikipedia

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