353915

Source:http://linkedlifedata.com/resource/chembl/compound/353915

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C20H18FN3O5S/c1-23(2)30(27,28)29-19-14-4-3-9-22-17(14)18(25)16-15(19)11-24(20(16)26)10-12-5-7-13(21)8-6-12/h3-9,25H,10-11H2,1-2H3
chemicalCompound:standardIn...	QSPZTSNQZUHYRV-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CN(C)S(=O)(=O)Oc1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c4ncccc14
chemicalCompound:molecularF...	C20H18FN3O5S
chemicalCompound:moleculeId	353915
chemicalCompound:mwFreebase	431.437
chemicalCompound:alogp	1.88
chemicalCompound:hba	6
chemicalCompound:hbd	1
chemicalCompound:psa	108.42
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	2.553
chemicalCompound:acdLogD	1.217
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	431.437
chemicalCompound:acdMostBpk...	8.074
chemicalCompound:chemblId	CHEMBL214371
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:453915
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:1758749, activity:1758750, activity:1758778, activity:1758869, activity:1758884, activity:1758928, activity:1758929, activity:1758930, activity:2920552