birabresib Report issue

Small molecule Experimental
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Chemistry

Mol. Mass

492.0

ALogP

5.53

Rule of 5

No

Rule of 3

No
Details
  • SMILES: Cc1sc2c(c1C)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)Nc1ccc(O)cc1)c1nnc(C)n1-2
  • InChIKey: GNMUEVRJHCWKTO-FQEVSTJZSA-N
    InChI=1S/C25H22ClN5O2S/c1-13-14(2)34-25-22(13)23(16-4-6-17(26)7-5-16)28-20(24-30-29-15(3)31(24)25)12-21(33)27-18-8-10-19(32)11-9-18/h4-11,20,32H,12H2,1-3H3,(H,27,33)/t20-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3581647   ChEMBL
birabresib

Birabresib   Wikipedia

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