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Small molecule Experimental
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Chemistry

Mol. Mass

424.52

ALogP

5.05

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CNc1ncc2cc(-c3cc(NC(=O)NCCC(C)(C)C)c(F)cc3C)c(C)nc2n1
  • InChIKey: HHCBMISMPSAZBF-UHFFFAOYSA-N
    InChI=1S/C23H29FN6O/c1-13-9-18(24)19(29-22(31)26-8-7-23(3,4)5)11-16(13)17-10-15-12-27-21(25-6)30-20(15)28-14(17)2/h9-12H,7-8H2,1-6H3,(H2,26,29,31)(H,25,27,28,30)
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3545195   ChEMBL
ly-3009120

CHEMBL3577124   ChEMBL
ly-3009120

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