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Chemistry

Mol. Mass

498.61

ALogP

0.9

Rule of 5

No

Rule of 3

No
Details
  • SMILES: C[C@H](O)C(=O)N1CCN(Cc2sc3c(nc(nc3c2C)c4cnc(N)nc4)N5CCOCC5)CC1
  • InChIKey: YOVVNQKCSKSHKT-HNNXBMFYSA-N
    InChI=1S/C23H30N8O3S/c1-14-17(13-29-3-5-31(6-4-29)22(33)15(2)32)35-19-18(14)27-20(16-11-25-23(24)26-12-16)28-21(19)30-7-9-34-10-8-30/h11-12,15,32H,3-10,13H2,1-2H3,(H2,24,25,26)/t15-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1922094   ChEMBL
apitolisib

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