619730

Source:http://linkedlifedata.com/resource/chembl/compound/619730

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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/C19H19F3N2O6S2/c20-19(21,22)14-2-1-3-15(12-14)31(25,26)23-6-8-24(9-7-23)32(27,28)16-4-5-17-18(13-16)30-11-10-29-17/h1-5,12-13H,6-11H2
chemicalCompound:standardIn...	ZRBJORGEGBDMJS-UHFFFAOYSA-N
chemicalCompound:canonicalS...	FC(F)(F)c1cccc(c1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)c3ccc4OCCOc4c3
chemicalCompound:molecularF...	C19H19F3N2O6S2
chemicalCompound:moleculeId	619730
chemicalCompound:mwFreebase	492.489
chemicalCompound:alogp	2.259
chemicalCompound:hba	6
chemicalCompound:hbd	0
chemicalCompound:psa	109.98
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.509
chemicalCompound:acdLogD	4.509
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	492.489
chemicalCompound:chemblId	CHEMBL1094007
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:719730
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:3241319, activity:3241376, activity:3241432, activity:3241510, activity:3241566, activity:3262053, activity:3262109, activity:3262205, activity:3262209, activity:3699548, activity:3942402, activity:4417387, activity:4443360, activity:4839399, activity:6618891, activity:7265020