623028

Source:http://linkedlifedata.com/resource/chembl/compound/623028

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Named Graph Language Inference

Statements in which the resource exists.
Subject	Predicate	Object	Context
chemicalCompound:623028	rdf:type	chembl:ChemicalCompound	lld:chembl
chemicalCompound:623028	chemicalCompound:standardIn...	InChI=1S/C16H9N5OS2/c23-16-21(10-5-2-1-3-6-10)14-12(24-16)15-18-13(11-7-4-8-22-11)19-20(15)9-17-14/h1-9H	lld:chembl
chemicalCompound:623028	chemicalCompound:standardIn...	DTOKGNWGWMEHFP-UHFFFAOYSA-N	lld:chembl
chemicalCompound:623028	chemicalCompound:canonicalS...	S=C1Sc2c(ncn3nc(nc23)c4occc4)N1c5ccccc5	lld:chembl
chemicalCompound:623028	chemicalCompound:molecularF...	C16H9N5OS2	lld:chembl
chemicalCompound:623028	chemicalCompound:moleculeId	623028	lld:chembl
chemicalCompound:623028	chemicalCompound:mwFreebase	351.406	lld:chembl
chemicalCompound:623028	chemicalCompound:alogp	4.939	lld:chembl
chemicalCompound:623028	chemicalCompound:hba	5	lld:chembl
chemicalCompound:623028	chemicalCompound:hbd	0	lld:chembl
chemicalCompound:623028	chemicalCompound:psa	116.85	lld:chembl
chemicalCompound:623028	chemicalCompound:rtb	2	lld:chembl
chemicalCompound:623028	chemicalCompound:ro3Pass	N	lld:chembl
chemicalCompound:623028	chemicalCompound:numRo5viol...	0	lld:chembl
chemicalCompound:623028	chemicalCompound:medChemFri...	N	lld:chembl
chemicalCompound:623028	chemicalCompound:acdLogP	4.04	lld:chembl
chemicalCompound:623028	chemicalCompound:acdLogD	4.04	lld:chembl
chemicalCompound:623028	chemicalCompound:molecularS...	molecularSpecies:NEUTRAL	lld:chembl
chemicalCompound:623028	chemicalCompound:fullMwt	351.406	lld:chembl
chemicalCompound:623028	chemicalCompound:chemblId	CHEMBL1090575	lld:chembl
chemicalCompound:623028	chemicalCompound:maxPhase	0	lld:chembl
chemicalCompound:623028	chemicalCompound:therapeuti...	0	lld:chembl
chemicalCompound:623028	chemicalCompound:dosedIngre...	No	lld:chembl
chemicalCompound:623028	chemicalCompound:structureT...	structureType:MOL	lld:chembl
chemicalCompound:623028	chemicalCompound:chebi	https://linkedlifedata.com/...	lld:chembl
chemicalCompound:623028	chemicalCompound:moleculeTy...	moleculeType:Small molecule	lld:chembl
chemicalCompound:623028	chemicalCompound:oral	No	lld:chembl
chemicalCompound:623028	chemicalCompound:parenteral	No	lld:chembl
chemicalCompound:623028	chemicalCompound:topical	No	lld:chembl
chemicalCompound:623028	chemicalCompound:blackBoxWa...	No	lld:chembl
chemicalCompound:623028	chemicalCompound:naturalPro...	No	lld:chembl
chemicalCompound:623028	chemicalCompound:proDrug	No	lld:chembl
chemicalCompound:623028	chemicalCompound:activity	activity:3243705	lld:chembl
chemicalCompound:623028	chemicalCompound:activity	activity:3243717	lld:chembl
chemicalCompound:623028	chemicalCompound:activity	activity:3243729	lld:chembl
http://linkedlifedata.com/r...	http://linkedlifedata.com/r...	chemicalCompound:623028	lld:chembl