Back

Chemistry

Mol. Mass

303.39

ALogP

1.41

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: O=C(N[C@H]1CN2CCC1CC2)C3=CNc4ccsc4C3=O
  • InChIKey: AFUWQWYPPZFWCO-LBPRGKRZSA-N
    InChI=1S/C15H17N3O2S/c19-13-10(7-16-11-3-6-21-14(11)13)15(20)17-12-8-18-4-1-9(12)2-5-18/h3,6-7,9,12H,1-2,4-5,8H2,(H,16,19)(H,17,20)/t12-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1643880   ChEMBL
pumosetrag

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