553809

Source:http://linkedlifedata.com/resource/chembl/compound/553809

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Named Graph Language Inference

Statements in which the resource exists.
Subject	Predicate	Object	Context
chemicalCompound:553809	rdf:type	chembl:ChemicalCompound	lld:chembl
chemicalCompound:553809	chemicalCompound:parent	chemicalCompound:67920	lld:chembl
chemicalCompound:553809	chemicalCompound:standardIn...	InChI=1S/C12H16NO2S.ClH/c14-11-5-6-12(15)13(11)7-1-2-8-16-9-3-4-10-16;/h3-10H2;1H/q+1;/p-1	lld:chembl
chemicalCompound:553809	chemicalCompound:standardIn...	JGQUBZMZEMUNKY-UHFFFAOYSA-M	lld:chembl
chemicalCompound:553809	chemicalCompound:canonicalS...	[Cl-].O=C1CCC(=O)N1CC#CC[S+]2CCCC2	lld:chembl
chemicalCompound:553809	chemicalCompound:molecularF...	C12H16ClNO2S	lld:chembl
chemicalCompound:553809	chemicalCompound:moleculeId	553809	lld:chembl
chemicalCompound:553809	chemicalCompound:mwFreebase	238.326	lld:chembl
chemicalCompound:553809	chemicalCompound:alogp	1.181	lld:chembl
chemicalCompound:553809	chemicalCompound:hba	0	lld:chembl
chemicalCompound:553809	chemicalCompound:hbd	4	lld:chembl
chemicalCompound:553809	chemicalCompound:psa	40.08	lld:chembl
chemicalCompound:553809	chemicalCompound:rtb	2	lld:chembl
chemicalCompound:553809	chemicalCompound:ro3Pass	N	lld:chembl
chemicalCompound:553809	chemicalCompound:numRo5viol...	0	lld:chembl
chemicalCompound:553809	chemicalCompound:medChemFri...	Y	lld:chembl
chemicalCompound:553809	chemicalCompound:molecularS...	molecularSpecies:NEUTRAL	lld:chembl
chemicalCompound:553809	chemicalCompound:fullMwt	273.779	lld:chembl
chemicalCompound:553809	chemicalCompound:chemblId	CHEMBL554629	lld:chembl
chemicalCompound:553809	chemicalCompound:maxPhase	0	lld:chembl
chemicalCompound:553809	chemicalCompound:therapeuti...	0	lld:chembl
chemicalCompound:553809	chemicalCompound:dosedIngre...	No	lld:chembl
chemicalCompound:553809	chemicalCompound:structureT...	structureType:MOL	lld:chembl
chemicalCompound:553809	chemicalCompound:chebi	https://linkedlifedata.com/...	lld:chembl
chemicalCompound:553809	chemicalCompound:moleculeTy...	moleculeType:Small molecule	lld:chembl
chemicalCompound:553809	chemicalCompound:oral	No	lld:chembl
chemicalCompound:553809	chemicalCompound:parenteral	No	lld:chembl
chemicalCompound:553809	chemicalCompound:topical	No	lld:chembl
chemicalCompound:553809	chemicalCompound:blackBoxWa...	No	lld:chembl
chemicalCompound:553809	chemicalCompound:naturalPro...	No	lld:chembl
chemicalCompound:553809	chemicalCompound:proDrug	No	lld:chembl
chemicalCompound:553809	chemicalCompound:activity	activity:912218	lld:chembl
chemicalCompound:553809	chemicalCompound:activity	activity:912219	lld:chembl
chemicalCompound:553809	chemicalCompound:activity	activity:912220	lld:chembl
chemicalCompound:553809	chemicalCompound:activity	activity:912221	lld:chembl
chemicalCompound:553809	chemicalCompound:activity	activity:912222	lld:chembl
chemicalCompound:553809	chemicalCompound:activity	activity:912223	lld:chembl
chemicalCompound:553809	chemicalCompound:activity	activity:912224	lld:chembl
chemicalCompound:553809	chemicalCompound:activity	activity:912225	lld:chembl
chemicalCompound:553809	chemicalCompound:activity	activity:912226	lld:chembl
chemicalCompound:553809	chemicalCompound:activity	activity:912227	lld:chembl
chemicalCompound:553809	chemicalCompound:activity	activity:912228	lld:chembl
chemicalCompound:553809	chemicalCompound:activity	activity:912229	lld:chembl
http://linkedlifedata.com/r...	http://linkedlifedata.com/r...	chemicalCompound:553809	lld:chembl