emeramide Report issue

Small molecule Experimental
AACT DrugBank PubChem

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Chemistry

Mol. Mass

284.41

ALogP

1.01

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: O=C(NCCS)c1cccc(C(=O)NCCS)c1
  • InChIKey: JUTBAVRYDAKVGQ-UHFFFAOYSA-N
    InChI=1S/C12H16N2O2S2/c15-11(13-4-6-17)9-2-1-3-10(8-9)12(16)14-5-7-18/h1-3,8,17-18H,4-7H2,(H,13,15)(H,14,16)
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL4297510   ChEMBL
emeramide

BDTH2   Wikipedia

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