Z5247692566

Z5247692566
Clinical data
Drug classSerotonin 5-HT2A receptor agonist
ATC code
  • None
Identifiers
  • 4-[(3,3-dimethyloxolan-2-yl)methyl]-3-[(1H-indol-3-yl)methyl]morpholine
Chemical and physical data
FormulaC20H28N2O2
Molar mass328.456 g·mol−1
3D model (JSmol)
  • CC1(C)CCOC1CN1CCOCC1Cc1c[NH]c2ccccc21
  • InChI=InChI=1S/C20H28N2O2/c1-20(2)7-9-24-19(20)13-22-8-10-23-14-16(22)11-15-12-21-18-6-4-3-5-17(15)18/h3-6,12,16,19,21H,7-11,13-14H2,1-2H3
  • Key:MWTNBIGFALLYOU-UHFFFAOYSA-N

Z5247692566 is a tryptamine derivative which acts as a serotonin 5-HT2A receptor agonist. It was discovered from a molecule docking screen against the AlphaFold model of the 5-HT2A receptor. It has two stereogenic centres and four possible isomers, but it is unclear which of these is the active isomer that was docked against 5-HT2A.[1]

See also

References

  1. ↑ Lyu J, Kapolka N, Gumpper R, Alon A, Wang L, Jain MK, et al. (June 2024). "AlphaFold2 structures guide prospective ligand discovery". Science. 384 (6702) eadn6354. Bibcode:2024Sci...384n6354L. doi:10.1126/science.adn6354. PMC 11253030. PMID 38753765.
This page is issued from Wikipedia. The text is available under Creative Commons Attribution-Share Alike 4.0 unless otherwise noted. Additional terms may apply for the media files.