cvl-865 Report issue

Small molecule Experimental

Back

Chemistry

Mol. Mass

440.5

ALogP

4.12

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCn1cnc2c(-c3ccc(F)c(-c4ccc(S(=O)(=O)CC)cc4OC)c3)cnnc21
  • InChIKey: PTTQXDBPTFOCMT-UHFFFAOYSA-N
    InChI=1S/C22H21FN4O3S/c1-4-27-13-24-21-18(12-25-26-22(21)27)14-6-9-19(23)17(10-14)16-8-7-15(11-20(16)30-3)31(28,29)5-2/h6-13H,4-5H2,1-3H3
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3647536   ChEMBL
darigabat

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