17980 <common-name>Sparfloxacin</common-name> <description nil="true"/> <cas>110871-86-8</cas> <pubchem-id>60464</pubchem-id> <chemical-formula>C19H22F2N4O3</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">2016-05-22T03:46:08Z</created-at> <updated-at type="dateTime">2026-05-14T16:58:45Z</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>DB01208</drugbank-id> <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>C[C@H]1CN(C[C@@H](C)N1)C1=C(F)C(N)=C2C(=O)C(=CN(C3CC3)C2=C1F)C(O)=O</moldb-smiles> <moldb-formula>C19H22F2N4O3</moldb-formula> <moldb-inchi>InChI=1S/C19H22F2N4O3/c1-8-5-24(6-9(2)23-8)17-13(20)15(22)12-16(14(17)21)25(10-3-4-10)7-11(18(12)26)19(27)28/h7-10,23H,3-6,22H2,1-2H3,(H,27,28)/t8-,9+</moldb-inchi> <moldb-inchikey>DZZWHBIBMUVIIW-DTORHVGOSA-N</moldb-inchikey> <moldb-average-mass type="decimal">392.3998</moldb-average-mass> <moldb-mono-mass type="decimal">392.165997</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-0.081</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>54517</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>CHEM016875</chemdb-id> <dsstox-id>DTXSID9023590</dsstox-id> <toxcast-id>23590</toxcast-id> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00007810</susdat-id> <iupac>5-amino-1-cyclopropyl-7-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-6,8-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid</iupac> <moldb-polar-surface-area>98.89999999999999</moldb-polar-surface-area> <moldb-refractivity>101.6938</moldb-refractivity> <moldb-polarizability>38.978715462680256</moldb-polarizability> <moldb-rotatable-bond-count>3</moldb-rotatable-bond-count> <moldb-acceptor-count>7</moldb-acceptor-count> <moldb-donor-count>3</moldb-donor-count> <moldb-pka-strongest-acidic>5.753208582916295</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>8.791968707803683</moldb-pka-strongest-basic> <moldb-physiological-charge>0</moldb-physiological-charge> <moldb-number-of-rings>4</moldb-number-of-rings> <moldb-alogps-logp>-0.07</moldb-alogps-logp> <moldb-alogps-logs>-3.54</moldb-alogps-logs> <moldb-alogps-solubility>1.13e-01 g/l</moldb-alogps-solubility> </compound>