140895 <common-name>Etiguanfacine</common-name> <description>Etiguanfacine belongs to the phenylacetamides, a subclass of benzene and substituted derivatives within the organic compounds. It is a benzenoid with the chemical formula C12H13Cl2N3O3 and an average molecular weight of 318.15 g/mol.</description> <cas>1346686-31-4</cas> <pubchem-id nil="true"/> <chemical-formula>C12H13Cl2N3O3</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">2026-04-15T17:03:55Z</created-at> <updated-at type="dateTime">2026-05-14T20:20:27Z</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>DB19917</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>CCOC(=O)NC(=N)NC(=O)CC1=C(Cl)C=CC=C1Cl</moldb-smiles> <moldb-formula>C12H13Cl2N3O3</moldb-formula> <moldb-inchi>InChI=1S/C12H13Cl2N3O3/c1-2-20-12(19)17-11(15)16-10(18)6-7-8(13)4-3-5-9(7)14/h3-5H,2,6H2,1H3,(H3,15,16,17,18,19)</moldb-inchi> <moldb-inchikey>NWKJFUNUXVXYGE-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">318.15</moldb-average-mass> <moldb-mono-mass type="decimal">317.0333967</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>CHEM136788</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac nil="true"/> <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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Phenylacetamides</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0116219</sync-id> <structure-inchikey>NWKJFUNUXVXYGE-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000000000800000000000000010000100000000000000000002001000000002000000040000000002000000000000000000000000000000000000020000000000400000000000000100000020000000000100004000000000000000000000010000000000000000000000000000000000000000020000000000040001000040000000800080010000000080000000000000000000020000000000000000000000000000000000080000000000000000002000000000000000000000000000000000000000000000000000000010000008002000000202000000000000200000000000000040000000000400000000000000000000000020002000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAUAAAAFAAAAIABBgBgAAAAAQMGAGAAAAAC AggAKAAAAAMCBgAoAAAAAwQIACgAAAADAgcAaAAAAAMCAQYAKAAAAAMEBwBo AAAAAwIBBwBoAAAAAwIBBgAoAAAAAwQIACgAAAADAgYAYAAAAAICBkAoAAAA AwQGQCgAAAADBBEAIAAAAAEGQGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwEG QCgAAAADBBEAIAAAAAELAAEAAQIAAgMgAwQoAgMFIAUGIAYHKAIGCCAICSAJ CigCCQsACwwADA1oDA0OAA0PaAwPEGgMEBFoDBESaAwSEwASDGgMQgEAAAAG DBIREA8NFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:51:37Z</structure-indexed-at> </compound>