1003168

Source:http://linkedlifedata.com/resource/chembl/compound/1003168

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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/C17H17N3O5S/c1-10-11(2)19-25-17(10)20-26(22,23)14-6-4-13(5-7-14)18-16(21)15-8-9-24-12(15)3/h4-9,20H,1-3H3,(H,18,21)
chemicalCompound:standardIn...	ZISKWQOROKXNJW-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1occc1C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3onc(C)c3C
chemicalCompound:molecularF...	C17H17N3O5S
chemicalCompound:moleculeId	1003168
chemicalCompound:mwFreebase	375.399
chemicalCompound:alogp	1.699
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	122.82
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	4.595
chemicalCompound:acdLogP	1.485
chemicalCompound:acdLogD	-0.348
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	375.399
chemicalCompound:chemblId	CHEMBL1579284
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1103168
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:3689993, activity:3764122, activity:3940828, activity:4315938, activity:4423719, activity:4622874, activity:4848086, activity:5026907, activity:6813487, activity:6921305, activity:7004708, activity:7052129, activity:7201688