19404 <common-name>Trimetazidine dihydrochloride</common-name> <description nil="true"/> <cas>13171-25-0</cas> <pubchem-id nil="true"/> <chemical-formula>C14H24Cl2N2O3</chemical-formula> <weight nil="true"/> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2016-05-22T05:08:19Z</created-at> <updated-at type="dateTime">2026-04-05T20:15:03Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>Cl.Cl.COC1=C(OC)C(OC)=C(CN2CCNCC2)C=C1</moldb-smiles> <moldb-formula>C14H24Cl2N2O3</moldb-formula> <moldb-inchi>InChI=1S/C14H22N2O3.2ClH/c1-17-12-5-4-11(13(18-2)14(12)19-3)10-16-8-6-15-7-9-16;;/h4-5,15H,6-10H2,1-3H3;2*1H</moldb-inchi> <moldb-inchikey>VYFLPFGUVGMBEP-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">339.26</moldb-average-mass> <moldb-mono-mass type="decimal">338.116398</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM018299</chemdb-id> <dsstox-id>DTXSID1045407</dsstox-id> <toxcast-id>45407</toxcast-id> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00084947</susdat-id> <iupac nil="true"/> <moldb-polar-surface-area>42.96000000000001</moldb-polar-surface-area> <moldb-refractivity>74.74570000000001</moldb-refractivity> <moldb-polarizability>29.154820146078933</moldb-polarizability> <moldb-rotatable-bond-count>5</moldb-rotatable-bond-count> <moldb-acceptor-count>5</moldb-acceptor-count> <moldb-donor-count>1</moldb-donor-count> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic>9.2147612185944</moldb-pka-strongest-basic> <moldb-physiological-charge>1</moldb-physiological-charge> <moldb-number-of-rings>2</moldb-number-of-rings> <moldb-alogps-logp>0.85</moldb-alogps-logp> <moldb-alogps-logs>-2.55</moldb-alogps-logs> <moldb-alogps-solubility>7.54e-01 g/l</moldb-alogps-solubility> </compound>