emedastine (emadine) Report issue

Small molecule Approved FDA
ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem repoDB

Back

Chemistry

Mol. Mass

302.42

ALogP

2.21

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCOCCn1c(N2CCCN(C)CC2)nc2ccccc21
  • InChIKey: KBUZBQVCBVDWKX-UHFFFAOYSA-N
    InChI=1S/C17H26N4O/c1-3-22-14-13-21-16-8-5-4-7-15(16)18-17(21)20-10-6-9-19(2)11-12-20/h4-5,7-8H,3,6,9-14H2,1-2H3
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL594   ChEMBL
emedastine *

CHEMBL2103739   ChEMBL
emedastine difumarate

9J1H7Y9OJV   NCATS
emedastine *

Emedastine   Wikipedia

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