16396 <common-name>1-(4-(Phenylazo)phenylazo)-2-naphthol</common-name> <description nil="true"/> <cas>85-86-9</cas> <pubchem-id>62331</pubchem-id> <chemical-formula>C22H16N4O</chemical-formula> <weight>352.4</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">2016-05-19T04:47:40Z</created-at> <updated-at type="dateTime">2026-04-17T19:25:10Z</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>OC1=C(\N=N\C2=CC=C(C=C2)\N=N\C2=CC=CC=C2)C2=CC=CC=C2C=C1</moldb-smiles> <moldb-formula>C22H16N4O</moldb-formula> <moldb-inchi>InChI=1S/C22H16N4O/c27-21-15-10-16-6-4-5-9-20(16)22(21)26-25-19-13-11-18(12-14-19)24-23-17-7-2-1-3-8-17/h1-15,27H/b24-23+,26-25+</moldb-inchi> <moldb-inchikey>FHNINJWBTRXEBC-QSZPNPOGSA-N</moldb-inchikey> <moldb-average-mass type="decimal">352.397</moldb-average-mass> <moldb-mono-mass type="decimal">352.132411151</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>16736189</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 nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM015291</chemdb-id> <dsstox-id>DTXSID3041742</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00000075</susdat-id> <iupac nil="true"/> <moldb-polar-surface-area>69.67</moldb-polar-surface-area> <moldb-refractivity>113.12710000000001</moldb-refractivity> <moldb-polarizability>39.2560310018439</moldb-polarizability> <moldb-rotatable-bond-count>4</moldb-rotatable-bond-count> <moldb-acceptor-count>5</moldb-acceptor-count> <moldb-donor-count>1</moldb-donor-count> <moldb-pka-strongest-acidic>11.33552193165185</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>0.22391273958478197</moldb-pka-strongest-basic> <moldb-physiological-charge>0</moldb-physiological-charge> <moldb-number-of-rings>4</moldb-number-of-rings> <moldb-alogps-logp>6.01</moldb-alogps-logp> <moldb-alogps-logs>-5.17</moldb-alogps-logs> <moldb-alogps-solubility>2.40e-03 g/l</moldb-alogps-solubility> </compound>