552513

Source:http://linkedlifedata.com/resource/chembl/compound/552513

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Named Graph Language Inference

Statements in which the resource exists.
Subject	Predicate	Object	Context
chemicalCompound:552513	rdf:type	chembl:ChemicalCompound	lld:chembl
chemicalCompound:552513	chemicalCompound:parent	chemicalCompound:663667	lld:chembl
chemicalCompound:552513	chemicalCompound:standardIn...	InChI=1S/C19H22ClNS.ClH/c1-19(2,3)11-6-5-7-12-21(4)13-15-9-8-10-17-18(15)16(20)14-22-17;/h5,7-10,14H,12-13H2,1-4H3;1H/b7-5+;	lld:chembl
chemicalCompound:552513	chemicalCompound:standardIn...	VQSNVJYBRJRPRW-GZOLSCHFSA-N	lld:chembl
chemicalCompound:552513	chemicalCompound:canonicalS...	Cl.CN(C\C=C\C#CC(C)(C)C)Cc1cccc2scc(Cl)c12	lld:chembl
chemicalCompound:552513	chemicalCompound:molecularF...	C19H23Cl2NS	lld:chembl
chemicalCompound:552513	chemicalCompound:moleculeId	552513	lld:chembl
chemicalCompound:552513	chemicalCompound:mwFreebase	331.903	lld:chembl
chemicalCompound:552513	chemicalCompound:alogp	5.953	lld:chembl
chemicalCompound:552513	chemicalCompound:hba	1	lld:chembl
chemicalCompound:552513	chemicalCompound:hbd	0	lld:chembl
chemicalCompound:552513	chemicalCompound:psa	31.47	lld:chembl
chemicalCompound:552513	chemicalCompound:rtb	6	lld:chembl
chemicalCompound:552513	chemicalCompound:ro3Pass	N	lld:chembl
chemicalCompound:552513	chemicalCompound:numRo5viol...	1	lld:chembl
chemicalCompound:552513	chemicalCompound:medChemFri...	Y	lld:chembl
chemicalCompound:552513	chemicalCompound:acdLogP	6.309	lld:chembl
chemicalCompound:552513	chemicalCompound:acdLogD	6.25	lld:chembl
chemicalCompound:552513	chemicalCompound:molecularS...	molecularSpecies:NEUTRAL	lld:chembl
chemicalCompound:552513	chemicalCompound:fullMwt	368.364	lld:chembl
chemicalCompound:552513	chemicalCompound:acdMostBpk...	6.569	lld:chembl
chemicalCompound:552513	chemicalCompound:chemblId	CHEMBL539314	lld:chembl
chemicalCompound:552513	chemicalCompound:maxPhase	0	lld:chembl
chemicalCompound:552513	chemicalCompound:therapeuti...	0	lld:chembl
chemicalCompound:552513	chemicalCompound:dosedIngre...	No	lld:chembl
chemicalCompound:552513	chemicalCompound:structureT...	structureType:MOL	lld:chembl
chemicalCompound:552513	chemicalCompound:chebi	https://linkedlifedata.com/...	lld:chembl
chemicalCompound:552513	chemicalCompound:moleculeTy...	moleculeType:Small molecule	lld:chembl
chemicalCompound:552513	chemicalCompound:oral	No	lld:chembl
chemicalCompound:552513	chemicalCompound:parenteral	No	lld:chembl
chemicalCompound:552513	chemicalCompound:topical	No	lld:chembl
chemicalCompound:552513	chemicalCompound:blackBoxWa...	No	lld:chembl
chemicalCompound:552513	chemicalCompound:naturalPro...	No	lld:chembl
chemicalCompound:552513	chemicalCompound:proDrug	No	lld:chembl
chemicalCompound:552513	chemicalCompound:activity	activity:931364	lld:chembl
chemicalCompound:552513	chemicalCompound:activity	activity:931365	lld:chembl
chemicalCompound:552513	chemicalCompound:activity	activity:931366	lld:chembl
chemicalCompound:552513	chemicalCompound:activity	activity:931367	lld:chembl
chemicalCompound:552513	chemicalCompound:activity	activity:931368	lld:chembl
chemicalCompound:552513	chemicalCompound:activity	activity:931369	lld:chembl
http://linkedlifedata.com/r...	http://linkedlifedata.com/r...	chemicalCompound:552513	lld:chembl