352510

Source:http://linkedlifedata.com/resource/chembl/compound/352510

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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/C15H17N5O5S/c1-19-13-11(14(22)20(2)15(19)23)17-12(18-13)9-3-5-10(6-4-9)26(24,25)16-7-8-21/h3-6,16,21H,7-8H2,1-2H3,(H,17,18)
chemicalCompound:standardIn...	VNXFJFCNDLPYDS-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CN1C(=O)N(C)c2[nH]c(nc2C1=O)c3ccc(cc3)S(=O)(=O)NCCO
chemicalCompound:molecularF...	C15 H17 N5 O5 S
chemicalCompound:moleculeId	352510
chemicalCompound:mwFreebase	379.391
chemicalCompound:alogp	-0.287
chemicalCompound:hba	6
chemicalCompound:hbd	3
chemicalCompound:psa	144.07
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	7.032
chemicalCompound:acdLogP	-1.724
chemicalCompound:acdLogD	-2.237
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	379.391
chemicalCompound:chemblId	CHEMBL377106
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:452510
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:1742756, activity:1742758, activity:1742759, activity:1742762, activity:1742763, activity:1742767, activity:1742768