281398 <common-name>2-[2-[(5-methyl-1h-imidazol-4-yl)methylsulfanyl]ethylamino]-1h-pyrimidin-6-one</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>3042926</pubchem-id> <chemical-formula>C11H15N5OS</chemical-formula> <weight>265.34</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">2026-08-27T16:40:00Z</created-at> <updated-at type="dateTime">2026-08-27T16:40:00Z</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>CC1=C(N=CN1)CSCCNC2=NC=CC(=O)N2</moldb-smiles> <moldb-formula>C11H15N5OS</moldb-formula> <moldb-inchi>InChI=1S/C11H15N5OS/c1-8-9(15-7-14-8)6-18-5-4-13-11-12-3-2-10(17)16-11/h2-3,7H,4-6H2,1H3,(H,14,15)(H2,12,13,16,17)</moldb-inchi> <moldb-inchikey>NGFLJJFIYZVOMH-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">265.0997313</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0</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>CHEM277291</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-[(5-methyl-1h-imidazol-4-yl)methylsulfanyl]ethylamino]-1h-pyrimidin-6-one</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>Pyrimidines and pyrimidine derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0233374</sync-id> <structure-inchikey>NGFLJJFIYZVOMH-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>c00000000800020000000100000000000000000000000000200000000020100000000000002000000000000000000000000000000000000000000000000000000000000000000020001000000800004001000000002000001000020000002000000000000000000000000000004000000000000000000000000040000000000000200000000880000002000000000000000000000002000000000000000000000000080000000080000000080000000000000000000000000000000000000010010080000000000000040000002000084200000000000000000020010000002040000040000000000000000000000002000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`������@(������@(������@(������@h�������@8��������`������� ������`�������`�������h�������@(������@(������@h�������@h�������@(�������(������@8������������h���h���h���h����������� � � � ��h�� h� �h���h���(���h���h���h�B������������ ��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:56:27Z</structure-indexed-at> </compound>