341105 <common-name>2-[[2-hydroxy-3-[(4-methoxyphenyl)carbamoyl]naphthalen-1-yl]diazenyl]-4-nitrobenzoic acid</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>135850911</pubchem-id> <chemical-formula>C25H18N4O7</chemical-formula> <weight>486.4</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">2026-08-31T01:14:16Z</created-at> <updated-at type="dateTime">2026-08-31T01:14:16Z</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>COC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=C2O)N=NC4=C(C=CC(=C4)[N+](=O)[O-])C(=O)O</moldb-smiles> <moldb-formula>C25H18N4O7</moldb-formula> <moldb-inchi>InChI=1S/C25H18N4O7/c1-36-17-9-6-15(7-10-17)26-24(31)20-12-14-4-2-3-5-18(14)22(23(20)30)28-27-21-13-16(29(34)35)8-11-19(21)25(32)33/h2-13,30H,1H3,(H,26,31)(H,32,33)</moldb-inchi> <moldb-inchikey>SYQRVOATYDISHE-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">486.1175489</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.3</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>CHEM336998</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>2-[[2-hydroxy-3-[(4-methoxyphenyl)carbamoyl]naphthalen-1-yl]diazenyl]-4-nitrobenzoic acid</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>Benzenoids</superklass> <klass>Naphthalenes</klass> <subklass>Naphthalenecarboxylic acids and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0291503</sync-id> <structure-inchikey>SYQRVOATYDISHE-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>2000000000001000000000000000000000000000000100200000000000000000000000000000200000000000000004000000000000000080000002000020000000000000000000000000002000000020000000000100001204000000400000040000010000010a53000000100000400000001000000000000000400000000000010040000401800000000000000080000000041100000000000000000020000000000000000000040000080000000000000000000000000001000000000080000000040080002000000000000000400000000000000000000200000000000000428000000801000040100000000400000800001000200100000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ����������������$���'���€���`�������(������@(������@h�������@h�������@(������@h�������@h��������h��������(�������(������@(������@h�������@(������@h�������@h�������@h�������@h�������@(������@(������@(�������h��������(�������(������@(������@(������@h�������@h�������@(������@h������� *��������(������ *���ÿ����(�������(�������h������������ ��h���h���h���h���h��� � (� � ��h�� h� �h���h���h���h���h���h���h��� �� ��(��� ��h���h���h���h���h��� ��(�� �! !"(�!# ��h���h�� h���h�B������������� ���������� �����������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:41:09Z</structure-indexed-at> </compound>