63931 <common-name>2-(Thiophen-2-yl)-1H-indole</common-name> <description nil="true"/> <cas>55968-16-6</cas> <pubchem-id>2795653</pubchem-id> <chemical-formula>C12H9N1S1</chemical-formula> <weight>199.27</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">2026-04-03T01:54:12Z</created-at> <updated-at type="dateTime">2026-08-18T22:15:12Z</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>N1C(=CC2=CC=CC=C12)C1=CC=CS1</moldb-smiles> <moldb-formula>C12H9N1S1</moldb-formula> <moldb-inchi>InChI=1S/C12H9NS/c1-2-5-10-9(4-1)8-11(13-10)12-6-3-7-14-12/h1-8,13H</moldb-inchi> <moldb-inchikey>YKSQPGLJCBOZNG-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">199.27</moldb-average-mass> <moldb-mono-mass type="decimal">199.04557</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.1</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>2074530</chemspider-id> <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>CHEM059824</chemdb-id> <dsstox-id>DTXSID80383803</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00016090</susdat-id> <iupac>2-thiophen-2-yl-1H-indole</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>Indoles and derivatives</klass> <subklass>Indoles</subklass> <paper-count type="integer">9</paper-count> <sync-id>CED0036663</sync-id> <structure-inchikey>YKSQPGLJCBOZNG-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20020000000020000000000000100000004000000000000400000000040000000000000000000000000010000000100000000000000000000000000000000000000000000000000000000000000000000400010000000000000000000000000000000000000000000000000100000000000000000000000000000000000000000000000000001800000200000000000000000000100000000000000000000000000000008000200000000080000000000000000000000000000000000000000000001002000000000000000000000000000000000000000004200000001000000004000000001000040000000000000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€��@8�������@(������@h�������@(������@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">2026-09-19T04:16:26Z</structure-indexed-at> </compound>