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Chemistry

Mol. Mass

518.6

ALogP

3.93

Rule of 5

No

Rule of 3

No
Details
  • SMILES: COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(S(=O)(=O)c4cccc(C(=O)N(C)C)c4)cc23)c1
  • InChIKey: JFHROPTYMMSOLG-UHFFFAOYSA-N
    InChI=1S/C27H26N4O5S/c1-16-11-21(37(34,35)20-10-5-7-17(12-20)27(33)31(2)3)14-22-24(16)29-15-23(26(28)32)25(22)30-18-8-6-9-19(13-18)36-4/h5-15H,1-4H3,(H2,28,32)(H,29,30)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL570015   ChEMBL
gsk-256066

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