453048

Source:http://linkedlifedata.com/resource/chembl/compound/453048

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Named Graph Language Inference

Statements in which the resource exists.
Subject	Predicate	Object	Context
chemicalCompound:453048	rdf:type	chembl:ChemicalCompound	lld:chembl
chemicalCompound:453048	chemicalCompound:standardIn...	InChI=1S/C17H14O5/c1-10(18)9-21-14-8-7-12-11-5-3-4-6-13(11)17(19)22-15(12)16(14)20-2/h3-8H,9H2,1-2H3	lld:chembl
chemicalCompound:453048	chemicalCompound:standardIn...	KXJLOTAAVRETIT-UHFFFAOYSA-N	lld:chembl
chemicalCompound:453048	chemicalCompound:canonicalS...	COc1c(OCC(=O)C)ccc2c1OC(=O)c3ccccc23	lld:chembl
chemicalCompound:453048	chemicalCompound:molecularF...	C17H14O5	lld:chembl
chemicalCompound:453048	chemicalCompound:moleculeId	453048	lld:chembl
chemicalCompound:453048	chemicalCompound:mwFreebase	298.29	lld:chembl
chemicalCompound:453048	chemicalCompound:alogp	2.499	lld:chembl
chemicalCompound:453048	chemicalCompound:hba	5	lld:chembl
chemicalCompound:453048	chemicalCompound:hbd	0	lld:chembl
chemicalCompound:453048	chemicalCompound:psa	61.83	lld:chembl
chemicalCompound:453048	chemicalCompound:rtb	4	lld:chembl
chemicalCompound:453048	chemicalCompound:ro3Pass	N	lld:chembl
chemicalCompound:453048	chemicalCompound:numRo5viol...	0	lld:chembl
chemicalCompound:453048	chemicalCompound:medChemFri...	Y	lld:chembl
chemicalCompound:453048	chemicalCompound:acdLogP	1.353	lld:chembl
chemicalCompound:453048	chemicalCompound:acdLogD	1.353	lld:chembl
chemicalCompound:453048	chemicalCompound:fullMwt	298.29	lld:chembl
chemicalCompound:453048	chemicalCompound:chemblId	CHEMBL520061	lld:chembl
chemicalCompound:453048	chemicalCompound:maxPhase	0	lld:chembl
chemicalCompound:453048	chemicalCompound:therapeuti...	0	lld:chembl
chemicalCompound:453048	chemicalCompound:dosedIngre...	No	lld:chembl
chemicalCompound:453048	chemicalCompound:structureT...	structureType:MOL	lld:chembl
chemicalCompound:453048	chemicalCompound:chebi	https://linkedlifedata.com/...	lld:chembl
chemicalCompound:453048	chemicalCompound:moleculeTy...	moleculeType:Small molecule	lld:chembl
chemicalCompound:453048	chemicalCompound:oral	No	lld:chembl
chemicalCompound:453048	chemicalCompound:parenteral	No	lld:chembl
chemicalCompound:453048	chemicalCompound:topical	No	lld:chembl
chemicalCompound:453048	chemicalCompound:blackBoxWa...	No	lld:chembl
chemicalCompound:453048	chemicalCompound:naturalPro...	No	lld:chembl
chemicalCompound:453048	chemicalCompound:proDrug	No	lld:chembl
chemicalCompound:453048	chemicalCompound:activity	activity:2592045	lld:chembl
chemicalCompound:453048	chemicalCompound:activity	activity:2592069	lld:chembl
chemicalCompound:453048	chemicalCompound:activity	activity:2592793	lld:chembl
http://linkedlifedata.com/r...	http://linkedlifedata.com/r...	chemicalCompound:453048	lld:chembl