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Chemistry

Mol. Mass

504.65

ALogP

1.56

Rule of 5

No

Rule of 3

No
Details
  • SMILES: CC(C)N1C(=O)C(=Cc2ccccc12)C(=O)N[C@H]3C[C@H]4CC[C@@H](C3)N4C[C@@H](O)CN(C)S(=O)(=O)C
  • InChIKey: HXLOHDZQBKCUCR-WOZUAGRISA-N
    InChI=1S/C25H36N4O5S/c1-16(2)29-23-8-6-5-7-17(23)11-22(25(29)32)24(31)26-18-12-19-9-10-20(13-18)28(19)15-21(30)14-27(3)35(4,33)34/h5-8,11,16,18-21,30H,9-10,12-15H2,1-4H3,(H,26,31)/t18-,19+,20-,21-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2087337   ChEMBL
velusetrag

Velusetrag   Wikipedia

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