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Chemistry

Mol. Mass

316.38

ALogP

2.89

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: O[C@H](C[C@H]1c2c(F)cccc2-c2cncn21)[C@H]1CC[C@H](O)CC1
  • InChIKey: YGACXVRLDHEXKY-WXRXAMBDSA-N
    InChI=1S/C18H21FN2O2/c19-14-3-1-2-13-16-9-20-10-21(16)15(18(13)14)8-17(23)11-4-6-12(22)7-5-11/h1-3,9-12,15,17,22-23H,4-8H2/t11-,12-,15-,17+/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3989951   ChEMBL
navoximod

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