279690 <common-name>7-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b][1,2,4]triazine</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>3054501</pubchem-id> <chemical-formula>C10H6ClN5</chemical-formula> <weight>231.64</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">2026-08-26T19:37:28Z</created-at> <updated-at type="dateTime">2026-08-26T19:37:28Z</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>C1=CC(=CC=C1C2=NC3=NN=CN3N=C2)Cl</moldb-smiles> <moldb-formula>C10H6ClN5</moldb-formula> <moldb-inchi>InChI=1S/C10H6ClN5/c11-8-3-1-7(2-4-8)9-5-13-16-6-12-15-10(16)14-9/h1-6H</moldb-inchi> <moldb-inchikey>KIMXUUNPCZOISW-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">231.0311729</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.4</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>CHEM275583</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>7-(4-chlorophenyl)-[1,2,4]triazolo[4,3-b][1,2,4]triazine</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>Benzene and substituted derivatives</klass> <subklass>Halobenzenes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0231742</sync-id> <structure-inchikey>KIMXUUNPCZOISW-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>9000000000000000000000000000000000000000000080000000000000004000000000000000020400002000000000000000000000000000000000000000000000400000000000000000008000000000000000000000000000000000000000000080000000000000000000800000000900000000000800080000001000000000020000000000001040000000880000000000000000000000000000001000000800000000000000080000000000000000000000000000000000000100000000000000000000000000000000000010000000000000000200000000000000001000000001000040000000000000000000000010000000000000000000</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� h� �h���h�� h� �h������h���h���h�B��������������� ��� ��� ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:54:57Z</structure-indexed-at> </compound>