104119 <common-name>Lersivirine</common-name> <description>Lersivirine is an organic compound with the chemical formula C17H18N4O2 and an average molecular weight of 310.36 g/mol. Lersivirine belongs to the ethers, a subclass of organooxygen compounds within the organic compounds. In terms of biological activity, it is recorded as an inhibitor of the Gag-Pol polyprotein (gag-pol).</description> <cas>473921-12-9</cas> <pubchem-id>16739244</pubchem-id> <chemical-formula>C17H18N4O2</chemical-formula> <weight>310.35</weight> <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">2026-04-05T11:26:00Z</created-at> <updated-at type="dateTime">2026-08-19T20:02:02Z</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>DB11649</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>CCC1=NN(CCO)C(CC)=C1OC1=CC(=CC(=C1)C#N)C#N</moldb-smiles> <moldb-formula>C17H18N4O2</moldb-formula> <moldb-inchi>InChI=1S/C17H18N4O2/c1-3-15-17(16(4-2)21(20-15)5-6-22)23-14-8-12(10-18)7-13(9-14)11-19/h7-9,22H,3-6H2,1-2H3</moldb-inchi> <moldb-inchikey>MCPUZZJBAHRIPO-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">310.357</moldb-average-mass> <moldb-mono-mass type="decimal">310.1429758</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.48</logp> <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>CHEM100012</chemdb-id> <dsstox-id>DTXSID0057881</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00068778</susdat-id> <iupac>5-{[3,5-diethyl-1-(2-hydroxyethyl)-1H-pyrazol-4-yl]oxy}benzene-1,3-dicarbonitrile</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Organic oxygen compounds</superklass> <klass>Organooxygen compounds</klass> <subklass>Ethers</subklass> <paper-count type="integer">117</paper-count> <sync-id>CED0018143</sync-id> <structure-inchikey>MCPUZZJBAHRIPO-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>8000080000040000000840002000000000000020000000000040002000000000000002002004000200400000000002000200000080000000000004000000000000000000000000000000000000000000000000020000100000000000010000000000200010000000000000000100000000000000100000000000000000000000100000040000000000000008000804000000000000000000000000000000000000000002000000000000000088000000000000000000000000000000000000000000000004000000000400000000000000000000000000000000000000000000108000000000000000040000048000000000000080000000000000000000000</structure-fingerprint> 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