sy-5609 Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

490.47

ALogP

4.71

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC1(C)CC[C@H](Nc2ncc(C(F)(F)F)c(-c3c[nH]c4c(P(C)(C)=O)c(C#N)ccc34)n2)CN1
  • InChIKey: JDJOUBVVSQDIRC-AWEZNQCLSA-N
    InChI=1S/C23H26F3N6OP/c1-22(2)8-7-14(10-30-22)31-21-29-12-17(23(24,25)26)18(32-21)16-11-28-19-15(16)6-5-13(9-27)20(19)34(3,4)33/h5-6,11-12,14,28,30H,7-8,10H2,1-4H3,(H,29,31,32)/t14-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL5090754   ChEMBL
sy-5609

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