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Chemistry

Mol. Mass

466.53

ALogP

2.03

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: Cc1c([C@@H](O)CN2CCN(C[C@H](O)c3ccc4c(c3C)COC4=O)CC2)ccc2c1COC2=O
  • InChIKey: OCKGFTQIICXDQW-ZEQRLZLVSA-N
    InChI=1S/C26H30N2O6/c1-15-17(3-5-19-21(15)13-33-25(19)31)23(29)11-27-7-9-28(10-8-27)12-24(30)18-4-6-20-22(16(18)2)14-34-26(20)32/h3-6,23-24,29-30H,7-14H2,1-2H3/t23-,24-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3696475   ChEMBL
mk-7145

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