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Chemistry

Mol. Mass

465.55

ALogP

2.6

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: NC(=O)CN1C(=O)C=C(CCN2CCN(CC2)c3nccc4sccc34)c5ccc(F)cc15
  • InChIKey: JDLYOFUDIKMYBL-UHFFFAOYSA-N
    InChI=1S/C24H24FN5O2S/c25-17-1-2-18-16(13-23(32)30(15-22(26)31)20(18)14-17)4-7-28-8-10-29(11-9-28)24-19-5-12-33-21(19)3-6-27-24/h1-3,5-6,12-14H,4,7-11,15H2,(H2,26,31)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3183740   ChEMBL
trelanserin

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