seletalisib Report issue

Small molecule Experimental
AACT DrugBank

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Chemistry

Mol. Mass

482.85

ALogP

5.24

Rule of 5

No

Rule of 3

No
Details
  • SMILES: [O-][n+]1cccc(-c2nc3c(Cl)cccc3cc2[C@@H](Nc2ncnc3cccnc23)C(F)(F)F)c1
  • InChIKey: LNLJHGXOFYUARS-OAQYLSRUSA-N
    InChI=1S/C23H14ClF3N6O/c24-16-6-1-4-13-10-15(18(31-19(13)16)14-5-3-9-33(34)11-14)21(23(25,26)27)32-22-20-17(29-12-30-22)7-2-8-28-20/h1-12,21H,(H,29,30,32)/t21-/m1/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4297648   ChEMBL
seletalisib

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