--- 
1: 
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: https://www.ebi.ac.uk/chembldb/compound/inspect/
    base_id_url_available: 1
    description: A database of bioactive drug-like small molecules and bioactivities abstracted from the scientific literature.
    name: chembl
    name_label: ChEMBL
    name_long: ChEMBL
    src_URL: https://www.ebi.ac.uk/chembl/
    src_details: Standard InChIs and Keys provided on ftp site for each release.
    src_id: 1
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: &1 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
            Matching_Query_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
            b: 0
            i: 0
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: CHEMBL436
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://www.drugbank.ca/drugs/
    base_id_url_available: 1
    description: A database that combines drug (i.e. chemical, pharmacological and pharmaceutical) data with drug target (i.e. sequence, structure, and pathway) information.
    name: drugbank
    name_label: DrugBank
    name_long: DrugBank
    src_URL: http://drugbank.ca/
    src_details: Standard InChIs and Keys provided within sd file on ftp site for each release.
    src_id: 2
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: DB02383
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://www.ebi.ac.uk/pdbe-srv/pdbechem/chemicalCompound/show/
    base_id_url_available: 1
    description: The European resource for the collection, organisation and dissemination of data on biological macromolecular structures, including structures of small molecule ligands for proteins.
    name: pdb
    name_label: PDBe
    name_long: PDBe (Protein Data Bank Europe)
    src_URL: http://www.ebi.ac.uk/pdbe/
    src_details: Standard InChIs and Keys provided by direct querying of Oracle DB.
    src_id: 3
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: TOL
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://www.guidetopharmacology.org/GRAC/LigandDisplayForward?ligandId=
    base_id_url_available: 1
    description: The IUPHAR (International Union of Basic and Clinical Pharmacology)/BPS (British Pharmacological Society) Guide to PHARMACOLOGY database contains structures of small molecule ligands, peptides and antibodies, with their affinities at protein targets.
    name: gtopdb
    name_label: Guide to Pharmacology
    name_long: Guide to Pharmacology
    src_URL: http://www.guidetopharmacology.org
    src_details: Standard InChIs and Keys available for download at http://www.guidetopharmacology.org/download.jsp
    src_id: 4
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 7404
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://pubchem.ncbi.nlm.nih.gov/substance/
    base_id_url_available: 1
    description: "A subset of the PubChem DB: from the original depositor 'drugs of the future' (Prous)."
    name: pubchem_dotf
    name_label: "PubChem: Drugs of the Future "
    name_long: PubChem ('Drugs of the Future' subset)
    src_URL: http://pubchem.ncbi.nlm.nih.gov/sources/sources.cgi
    src_details: Mol files for SIDs downloaded manually, via PubChem interface, and Standard InChIs and Keys generated by InChI software. SIDs used as identifiers.
    src_id: 5
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 12014205
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://www.genome.jp/dbget-bin/www_bget?
    base_id_url_available: 1
    description: KEGG LIGAND is a composite DB consisting of COMPOUND, GLYCAN, REACTION, RPAIR, RCLASS, and ENZYME DBs, whose entries are identified by C, G, R, RP, RC, and EC numbers, respectively.
    name: kegg_ligand
    name_label: KEGG Ligand
    name_long: KEGG (Kyoto Encyclopedia of Genes and Genomes) Ligand
    src_URL: http://www.genome.jp/kegg/ligand.html
    src_details: Mol files were downloaded manually prior to this download becoming private. Standard InChIs and Keys generated by InChI software.
    src_id: 6
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: C01621
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI%3A
    base_id_url_available: 1
    description: ChEBI is a freely available dictionary of molecular entities focused on 'small' chemical compounds
    name: chebi
    name_label: ChEBI
    name_long: ChEBI (Chemical Entities of Biological Interest).
    src_URL: http://www.ebi.ac.uk/chebi/downloadsForward.do
    src_details: Std InChis (but no keys) provided on ftp site. Keys generated by UniChem. 'all star' compounds downloaded
    src_id: 7
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 48549
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://zinc15.docking.org/substances/
    base_id_url_available: 1
    description: A free database of commercially-available compounds for virtual screening, provided by the Shoichet Laboratory in the Department of Pharmaceutical Chemistry at the University of California, San Francisco (UCSF).  [Irwin and Shoichet, J. Chem. Inf. Model. 2005;45(1):177-82]
    name: zinc
    name_label: ZINC
    name_long: ZINC
    src_URL: http://zinc15.docking.org
    src_details: novirtual subset of ZINC15, as a file containing inchis and keys from http://files.docking.org/export/unichem/
    src_id: 9
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: ZINC000003780343
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://www-935.ibm.com/services/us/gbs/bao/siip/nih/?sid=
    base_id_url_available: 1
    description: The data are provided by IBM-NIH and include all chemistry extracted by means of text and image mining from the patent corpus (USPTO, WIPO and EPO) for patent documents published through 31-12-2010. Identifiers in UniChem are IBM compound identifiers.
    name: ibm
    name_label: IBM Patent System
    name_long: IBM strategic IP insight platform and the National Institutes of Health
    src_URL: http://www-935.ibm.com/services/us/gbs/bao/siip/nih/
    src_details: InChIs and InChI keys were generated from SMILES in house.
    src_id: 11
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 1E9F76F2622BFC58433B198D377047CB
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://fdasis.nlm.nih.gov/srs/ProxyServlet?mergeData=true&objectHandle=DBMaint&APPLICATION_NAME=fdasrs&actionHandle=default&nextPage=jsp/srs/ResultScreen.jsp&TXTSUPERLISTID=
    base_id_url_available: 1
    description: "The primary goal of the FDA/USP Substance Registration System (SRS) is to unambiguously define all substances present in regulated products. Once a substance has been defined, the SRS assigns a strong identifier that is permanently associated with the substance: a UNII (Unique Ingredient Identifier). This is a a non-proprietary, free, unique, unambiguous, nonsemantic, alphanumeric identifier based on a substances molecular structure and/or descriptive information."
    name: fdasrs
    name_label: FDA SRS
    name_long: FDA/USP Substance Registration System (SRS)
    src_URL: http://fdasis.nlm.nih.gov/srs/srs.jsp
    src_details: Download of InChIKeys in file UNII Data  from http://fdasis.nlm.nih.gov/srs/jsp/srs/uniiListDownload.jsp
    src_id: 14
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 0T93LG5NMK
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: https://www.surechembl.org/chemical/
    base_id_url_available: 1
    description: SureChEMBL automatically extracts chemistry from the full text of all major patent authorities. Compounds are derived from either chemical names found in text or in chemical depictions. All SureChEMBL compounds are included, except those failing UniChem loading rules.
    name: surechembl
    name_label: SureChEMBL
    name_long: SureChEMBL
    src_URL: https://www.surechembl.org/search/
    src_details: Standard InChIs and InChIKeys provided by a direct feed from the SureChEMBL database
    src_id: 15
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: SCHEMBL49326
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://pubchem.ncbi.nlm.nih.gov/substance/
    base_id_url_available: 1
    description: "A subset of the PubChem DB: from the original depositor 'Thomson Pharma'."
    name: pubchem_tpharma
    name_label: "PubChem: Thomson Pharma "
    name_long: PubChem ('Thomson Pharma' subset)
    src_URL: http://www.thomson-pharma.com/
    src_details: Mol files for SIDs downloaded manually, via PubChem interface, and Standard InChIs and Keys generated by InChI software. SIDs used as identifiers.
    src_id: 21
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 14803262
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://pubchem.ncbi.nlm.nih.gov/compound/
    base_id_url_available: 1
    description: A database of normalized PubChem compounds (CIDs) from the PubChem Database.
    name: pubchem
    name_label: PubChem
    name_long: PubChem Compounds
    src_URL: http://pubchem.ncbi.nlm.nih.gov
    src_details: Standard InChIs and Keys provided on ftp site.
    src_id: 22
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-FIBGUPNXSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)/i1D3
        assignment: 1
        aux_src: ~
        match_compare: 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)/i1D3
            Matching_Query_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 91971719
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 53359
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://actor.epa.gov/actor/chemical.xhtml?casrn=
    base_id_url_available: 1
    description: ACToR (Aggregated Computational Toxicology Resource)
    name: actor
    name_label: ACToR
    name_long: ACToR
    src_URL: https://actor.epa.gov
    src_details: Standard InChIs and Keys generated from SMILES from DB download
    src_id: 26
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 82964-04-3
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: https://www.molport.com/shop/molecule-link/
    base_id_url_available: 1
    description: MolPort. A database designed to assist users find commercial sources of compounds. Access requires (free) registration. Only stock compounds included from Nov 2017.
    name: molport
    name_label: MolPort
    name_long: MolPort
    src_URL: https://www.molport.com/shop/index
    src_details: Standard InChIs and Keys provided on from MolPort ftp site, access on request.
    src_id: 28
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: MolPort-006-168-350
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=
    base_id_url_available: 1
    description: " Nakkaji (The Japan Chemical Substance Dictionary) is an organic compound dictionary database prepared by the Japan Science and Technology Agency (JST)."
    name: nikkaji
    name_label: Nikkaji
    name_long: Nikkaji
    src_URL: http://jglobal.jst.go.jp/en/
    src_details: Standard InChIs and Keys available from ftp site
    src_id: 29
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: J23.281E
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=
    base_id_url_available: 1
    description: A public, web-accessible database of measured binding affinities, focusing chiefly on the interactions of proteins considered to be drug-targets with small, drug-like molecules
    name: bindingdb
    name_label: BindingDB
    name_long: BindingDB
    src_URL: https://www.bindingdb.org/bind/index.jsp
    src_details: Standard InChIs and Keys available within a tsv file from download page.
    src_id: 31
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 16314
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: https://comptox.epa.gov/dashboard/
    base_id_url_available: 1
    description: The foundation of chemical safety testing relies on chemistry information such as high-quality chemical structures and physicochemical properties. This information is used by scientists to predict the potential health risks of chemicals.The CompTox Dashboard is part of a suite of dashboards developed by EPA to help evaluate the safety of chemicals. It provides access to a variety of data and information on over 700,000 chemicals currently in use and of interest to environmental researchers. Within the CompTox Dashboard, users can access chemical structures, experimental and predicted physicochemical and toxicity data, and additional links to relevant websites and applications. It maps curated physicochemical property data associated with chemical substances to their corresponding chemical structures
    name: comptox
    name_label: EPA CompTox Dashboard
    name_long: EPA (Environmental Protection Agency) CompTox Dashboard
    src_URL: https://comptox.epa.gov/dashboard/
    src_details: Standard InChIs and Keys obtained from download page
    src_id: 32
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: DTXSID6048834
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: http://drugcentral.org/drugcard/
    base_id_url_available: 1
    description: DrugCentral is an online drug information resource created and maintained by Division of Translational Informatics at University of New Mexico, providing information on active ingredients chemical entities, pharmaceutical products, drug mode of action, indications, pharmacologic action
    name: drugcentral
    name_label: DrugCentral
    name_long: DrugCentral
    src_URL: http://drugcentral.org
    src_details: Standard InChIs and Keys available as a download.
    src_id: 34
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 2704
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: https://www.brenda-enzymes.org/ligand.php?brenda_ligand_id=
    base_id_url_available: 1
    description: A comprehensive Enzyme Information system containing enzyme functional data extracted directly from the primary literature.
    name: brenda
    name_label: Brenda
    name_long: Brenda
    src_URL: https://www.brenda-enzymes.org/index.php
    src_details: Standard InChIKeys available as a download
    src_id: 37
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 1478
  - 
    Full Query InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
    Full Query InChIKey: LUBHDINQXIHVLS
    aux_for_url: 0
    base_id_url: https://www.chemicalbook.com/ChemicalProductProperty_EN_
    base_id_url_available: 1
    description: An online knowledge-base of chemicals and a platform of the Chinese domestic vendors in chemical industry
    name: chemicalbook
    name_label: ChemicalBook
    name_long: ChemicalBook
    src_URL: https://www.chemicalbook.com
    src_details: Standard InChIs and Keys provided by email.
    src_id: 39
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: LUBHDINQXIHVLS-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C16H14F3NO3S/c1-20(8-13(21)22)15(24)11-5-3-4-10-9(11)6-7-12(23-2)14(10)16(17,18)19/h3-7H,8H2,1-2H3,(H,21,22)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: CB2174693