19721 <common-name>Alexidine dihydrochloride</common-name> <description nil="true"/> <cas>1715-30-6</cas> <pubchem-id nil="true"/> <chemical-formula>C26H58Cl2N10</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">2016-05-22T05:23:43Z</created-at> <updated-at type="dateTime">2026-04-05T19:17:01Z</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>Cl.Cl.CCCCC(CC)CNC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NCC(CC)CCCC</moldb-smiles> <moldb-formula>C26H58Cl2N10</moldb-formula> <moldb-inchi>InChI=1S/C26H56N10.2ClH/c1-5-9-15-21(7-3)19-33-25(29)35-23(27)31-17-13-11-12-14-18-32-24(28)36-26(30)34-20-22(8-4)16-10-6-2;;/h21-22H,5-20H2,1-4H3,(H5,27,29,31,33,35)(H5,28,30,32,34,36);2*1H</moldb-inchi> <moldb-inchikey>BRJJFBHTDVWTCJ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">581.72</moldb-average-mass> <moldb-mono-mass type="decimal">580.4222973</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>CHEM018616</chemdb-id> <dsstox-id>DTXSID5045881</dsstox-id> <toxcast-id>45881</toxcast-id> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00082334</susdat-id> <iupac nil="true"/> <moldb-polar-surface-area>167.58</moldb-polar-surface-area> <moldb-refractivity>193.28460000000004</moldb-refractivity> <moldb-polarizability>63.374446888304284</moldb-polarizability> <moldb-rotatable-bond-count>19</moldb-rotatable-bond-count> <moldb-acceptor-count>10</moldb-acceptor-count> <moldb-donor-count>10</moldb-donor-count> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic>12.196526610917093</moldb-pka-strongest-basic> <moldb-physiological-charge>4</moldb-physiological-charge> <moldb-number-of-rings>0</moldb-number-of-rings> <moldb-alogps-logp>2.77</moldb-alogps-logp> <moldb-alogps-logs>-4.27</moldb-alogps-logs> <moldb-alogps-solubility>2.71e-02 g/l</moldb-alogps-solubility> </compound>