duloxetine (Cymbalta) Report issue

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

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Chemistry

Mol. Mass

297.42

ALogP

4.63

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CNCC[C@H](Oc1cccc2ccccc12)c1cccs1
  • InChIKey: ZEUITGRIYCTCEM-KRWDZBQOSA-N
    InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1175   ChEMBL
duloxetine *

CHEMBL1200328   ChEMBL
duloxetine hydrochloride

O5TNM5N07U   NCATS
duloxetine *

Duloxetine   Wikipedia

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