1114889

Source:http://linkedlifedata.com/resource/chembl/compound/1114889

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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/C17H24N2O4S/c1-9-10(2)12(4)16(13(5)11(9)3)24(22,23)19-14(6)15(7-8-20)17(21)18-19/h20H,7-8H2,1-6H3,(H,18,21)
chemicalCompound:standardIn...	YPBVQJYYMGQZJG-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC1=C(CCO)C(=O)NN1S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C
chemicalCompound:molecularF...	C17H24N2O4S
chemicalCompound:moleculeId	1114889
chemicalCompound:mwFreebase	352.448
chemicalCompound:alogp	2.572
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	95.09
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	4.941
chemicalCompound:acdLogP	1.858
chemicalCompound:acdLogD	0
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	352.448
chemicalCompound:chemblId	CHEMBL1734158
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1214889
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:5468897, activity:5757410, activity:5932573, activity:6870894, activity:7470937, activity:7529414