masupirdine Report issue

Small molecule Experimental
AACT PubChem

Back

Chemistry

Mol. Mass

478.41

ALogP

3.4

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: COc1ccc2c(c1)c(CN1CCN(C)CC1)cn2S(=O)(=O)c1ccccc1Br
  • InChIKey: GWCYPEHWIZXYFZ-UHFFFAOYSA-N
    InChI=1S/C21H24BrN3O3S/c1-23-9-11-24(12-10-23)14-16-15-25(20-8-7-17(28-2)13-18(16)20)29(26,27)21-6-4-3-5-19(21)22/h3-8,13,15H,9-12,14H2,1-2H3
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4117187   ChEMBL
masupirdine

Feedback

Data collection and curation is an ongoing process for CDEK - if you notice any information here to be missing or incorrect, please let us know! When possible, please include a source URL (we verify all data prior to inclusion).

Report issue