171426

Source:http://linkedlifedata.com/resource/chembl/compound/171426

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:15423
chemicalCompound:standardIn...	InChI=1S/C19H15F3N4O3.C7H8O3S/c20-9-1-2-15(13(21)5-9)26-8-12(19(28)29)16(27)11-6-14(22)18(24-17(11)26)25-4-3-10(23)7-25;1-6-2-4-7(5-3-6)11(8,9)10/h1-2,5-6,8,10H,3-4,7,23H2,(H,28,29);2-5H,1H3,(H,8,9,10)
chemicalCompound:standardIn...	CSSQVOKOWWIUCX-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1ccc(cc1)S(=O)(=O)O.NC2CCN(C2)c3nc4N(C=C(C(=O)O)C(=O)c4cc3F)c5ccc(F)cc5F
chemicalCompound:molecularF...	C19 H15 F3 N4 O3 . C7 H8 O3 S
chemicalCompound:moleculeId	171426
chemicalCompound:mwFreebase	404.343
chemicalCompound:alogp	-0.579
chemicalCompound:hba	7
chemicalCompound:hbd	2
chemicalCompound:psa	99.76
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	5.786
chemicalCompound:acdLogP	1.007
chemicalCompound:acdLogD	-1.269
chemicalCompound:molecularS...	molecularSpecies:ZWITTERION
chemicalCompound:fullMwt	576.544
chemicalCompound:acdMostBpk...	8.763
chemicalCompound:chemblId	CHEMBL104270
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:271426
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	TOSUFLOXACIN TOSYLATE
chemicalCompound:activity	activity:1278805, activity:1278806, activity:1278807, activity:1278808, activity:1278809, activity:1278810, activity:1278811, activity:1278812, activity:1278813, activity:1278814, activity:1278815, activity:1278816, activity:3621172, activity:3767473, activity:4127646, activity:4302725, activity:4416562, activity:4682431, activity:4690529, activity:4937578, activity:4992849, activity:5011733, activity:5020152, activity:5360781, activity:5458535, activity:6437923, activity:6799366, activity:6857647, activity:6933470, activity:7039151