322744 <common-name>4-[[6-(4-carbamimidoylphenyl)-2-methyl-3-oxopyridazine-4-carbonyl]amino]cyclohexane-1-carboxylic acid</common-name> <description>4-[[6-(4-carbamimidoylphenyl)-2-methyl-3-oxopyridazine-4-carbonyl]amino]cyclohexane-1-carboxylic acid is a chemical compound with the formula C20H23N5O4. It has an average molecular weight of 397.40 g/mol.</description> <cas>150594-76-6</cas> <pubchem-id>3073585</pubchem-id> <chemical-formula>C20H23N5O4</chemical-formula> <weight>397.4</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">2026-08-29T23:04:14Z</created-at> <updated-at type="dateTime">2026-08-29T23:04:14Z</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>CN1C(=O)C(=CC(=N1)C2=CC=C(C=C2)C(=N)N)C(=O)NC3CCC(CC3)C(=O)O</moldb-smiles> <moldb-formula>C20H23N5O4</moldb-formula> <moldb-inchi>InChI=1S/C20H23N5O4/c1-25-19(27)15(18(26)23-14-8-6-13(7-9-14)20(28)29)10-16(24-25)11-2-4-12(5-3-11)17(21)22/h2-5,10,13-14H,6-9H2,1H3,(H3,21,22)(H,23,26)(H,28,29)</moldb-inchi> <moldb-inchikey>XECFEKYYVYEYTF-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">397.1750042</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.7</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>CHEM318637</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>4-[[6-(4-carbamimidoylphenyl)-2-methyl-3-oxopyridazine-4-carbonyl]amino]cyclohexane-1-carboxylic 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>Organoheterocyclic compounds</superklass> <klass>Diazines</klass> <subklass>Pyridazines and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0273446</sync-id> <structure-inchikey>XECFEKYYVYEYTF-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000000000800000002000000000000008000000000000000000000000000000008000000000200000a0000000002014000000000000000000000002000080000000000000000000000001000500000020081000000000000000000000000000000001010000000000000000100000a000000201000000000208000000001000000020400000000000c0000000044080801000000000000000000020000000000000000004000000000000084000000000010000000000000000000000000000000000000000000000000020000100000000004000000000000200000000000000000000000000000040000000000400000000080010000100000000000000</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����B������������ �� ������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:27:11Z</structure-indexed-at> </compound>