362137 <common-name>2-[4-(methylamino)butylamino]ethylsulfanylphosphonic acid</common-name> <description>2-[4-(methylamino)butylamino]ethylsulfanylphosphonic acid is a compound with the formula C7H19N2O3PS. It has an average molecular weight of 242.28 g/mol.</description> <cas nil="true"/> <pubchem-id>116065</pubchem-id> <chemical-formula>C7H19N2O3PS</chemical-formula> <weight>242.28</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">2026-09-01T11:14:33Z</created-at> <updated-at type="dateTime">2026-09-01T11:14:33Z</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>CNCCCCNCCSP(=O)(O)O</moldb-smiles> <moldb-formula>C7H19N2O3PS</moldb-formula> <moldb-inchi>InChI=1S/C7H19N2O3PS/c1-8-4-2-3-5-9-6-7-14-13(10,11)12/h8-9H,2-7H2,1H3,(H2,10,11,12)</moldb-inchi> <moldb-inchikey>YNQWVMKWBKOAKC-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">242.0854006</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-3.6</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>CHEM358030</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-[4-(methylamino)butylamino]ethylsulfanylphosphonic 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>Organophosphorus compounds</superklass> <klass>Organothiophosphorus compounds</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0312232</sync-id> <structure-inchikey>YNQWVMKWBKOAKC-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400800000000800002000000000000080000000000000000000000000000000000000000000000000000000000000000000000002000000000000000000000000008000000000000020001000000000000000000000000010010000010000000000040000000000000000000000000000000000000800000000000040000000000000000000000080000002000000000000000000000000000000000020010000000000000000000000020000000000000000000080000000000000000000000000000000000000000000000000000000020000000000000000000000020000000000000000010000000000000000000010000000000002</structure-fingerprint> <structure-pattern-fingerprint>30000000810280000000000001002000000000100005000000200040020000044000004000800000000001000000000006200000000410000000443000a00000849104001000030000801000004208000000000040002012080004a0000000000c2000000040020000000000531000002000801003008004111800000010000200400008044002080c00020008080008100400124400100200000b00000040004243000000004000000008000024201002c000000001080010000000060002004c008004040000021080000000008280000000000000400000001000080000300000080000000000000000000000200000000010004000000000000050000002</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ�������������������� ���€���`�������`�������`�������`�������`�������`�������`�������`�������`������� ������ ������(�������`�������`������������������������������� � � ��� �� �B��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:59:16Z</structure-indexed-at> </compound>