1062503

Source:http://linkedlifedata.com/resource/chembl/compound/1062503

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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/C6H6O2S/c1-4-6(7)5(9)2-3-8-4/h2-3,7H,1H3
chemicalCompound:standardIn...	GKLSXUGPECNEMX-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC1=C(O)C(=S)C=CO1
chemicalCompound:molecularF...	C6H6O2S
chemicalCompound:moleculeId	1062503
chemicalCompound:mwFreebase	142.176
chemicalCompound:alogp	0.677
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	61.55
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	7.576
chemicalCompound:acdLogP	0.222
chemicalCompound:acdLogD	0
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	142.176
chemicalCompound:chemblId	CHEMBL1650615
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1162503
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:5186727, activity:5186736, activity:5194096, activity:5194168, activity:5194243, activity:5194244, activity:5194248, activity:5194319, activity:5194410, activity:5194422