<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">3046</id>
  <title>T3D3004</title>
  <common-name>Moclobemide</common-name>
  <description>Moclobemide is only found in individuals that have used or taken this drug. It is a reversible monoamine oxidase inhibitor (MAOI) selective for isoform A (RIMA) used to treat major depressive disorder. The mechanism of action of moclobemide involves the selective, reversible inhibition of MAO-A. This inhibition leads to a decrease in the metabolism and destruction of monoamines in the neurotransmitters. This results in an increase in the monoamines, relieving depressive symptoms.</description>
  <cas>71320-77-9</cas>
  <pubchem-id>4235</pubchem-id>
  <chemical-formula>C13H17ClN2O2</chemical-formula>
  <weight>268.097860</weight>
  <appearance>White powder.</appearance>
  <melting-point></melting-point>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility>1.12e+00 g/L</solubility>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure>Well absorbed from the gastrointestinal tract (&gt; 95%). The presence of food reduces the rate but not the extent of absorption. Hepatic first pass metabolism reduces bioavailability to 45-70% following administration of a single dose, but increases to 80% with multiple dosing as a result of saturation of the first pass effect. Peak plasma concentrations are reached within 1 - 2 hours following oral administration.</route-of-exposure>
  <target nil="true"/>
  <mechanism-of-toxicity>The mechanism of action of moclobemide involves the selective, reversible inhibition of MAO-A. This inhibition leads to a decrease in the metabolism and destruction of monoamines in the neurotransmitters. This results in an increase in the monoamines, relieving depressive symptoms.</mechanism-of-toxicity>
  <metabolism>Moclobemide is almost completely metabolized in the liver by Cytochrome P450 2C19 and 2D6.Half Life: 1-2 hours (4 hours in cirrhotic patients); metabolites are renally excreted</metabolism>
  <toxicity>LD50: 730mg/kg (Mouse) (A308)LD50: 1300mg/kg (Rat) (A308)</toxicity>
  <lethaldose nil="true"/>
  <carcinogenicity>No indication of carcinogenicity to humans (not listed by IARC).</carcinogenicity>
  <use-source>For the treatment of depression.</use-source>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms></symptoms>
  <treatment nil="true"/>
  <created-at type="dateTime">2009-07-21T20:28:31Z</created-at>
  <updated-at type="dateTime">2014-12-24T20:25:55Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia>Moclobemide</wikipedia>
  <uniprot-id></uniprot-id>
  <kegg-compound-id></kegg-compound-id>
  <omim-id></omim-id>
  <chebi-id>239099</chebi-id>
  <biocyc-id></biocyc-id>
  <ctd-id nil="true"/>
  <stitch-id>Moclobemide</stitch-id>
  <drugbank-id>DB01171</drugbank-id>
  <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>ClC1=CC=C(C=C1)C(=O)NCCN1CCOCC1</moldb-smiles>
  <moldb-formula>C13H17ClN2O2</moldb-formula>
  <moldb-inchi>InChI=1S/C13H17ClN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17)</moldb-inchi>
  <moldb-inchikey>InChIKey=YHXISWVBGDMDLQ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">268.739</moldb-average-mass>
  <moldb-mono-mass type="decimal">268.097855505</moldb-mono-mass>
  <origin>Exogenous</origin>
  <state>Solid</state>
  <logp>1.5</logp>
  <hmdb-id>HMDB15302</hmdb-id>
  <chembl-id>CHEMBL86304</chembl-id>
  <chemspider-id>4087</chemspider-id>
  <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></synthesis-reference>
  <structure-image-caption nil="true"/>
</compound>
