399899

Source:http://linkedlifedata.com/resource/chembl/compound/399899

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Named Graph Language Inference

Statements in which the resource exists.
Subject	Predicate	Object	Context
chemicalCompound:399899	rdf:type	chembl:ChemicalCompound	lld:chembl
chemicalCompound:399899	chemicalCompound:standardIn...	InChI=1S/C12H13N3O/c13-12-14-10(8-11(16)15-12)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H3,13,14,15,16)	lld:chembl
chemicalCompound:399899	chemicalCompound:standardIn...	CNBSPUGFNQVSJS-UHFFFAOYSA-N	lld:chembl
chemicalCompound:399899	chemicalCompound:canonicalS...	NC1=NC(=CC(=O)N1)CCc2ccccc2	lld:chembl
chemicalCompound:399899	chemicalCompound:molecularF...	C12H13N3O	lld:chembl
chemicalCompound:399899	chemicalCompound:moleculeId	399899	lld:chembl
chemicalCompound:399899	chemicalCompound:mwFreebase	215.251	lld:chembl
chemicalCompound:399899	chemicalCompound:alogp	1.568	lld:chembl
chemicalCompound:399899	chemicalCompound:hba	3	lld:chembl
chemicalCompound:399899	chemicalCompound:hbd	2	lld:chembl
chemicalCompound:399899	chemicalCompound:psa	67.47	lld:chembl
chemicalCompound:399899	chemicalCompound:rtb	3	lld:chembl
chemicalCompound:399899	chemicalCompound:ro3Pass	N	lld:chembl
chemicalCompound:399899	chemicalCompound:numRo5viol...	0	lld:chembl
chemicalCompound:399899	chemicalCompound:medChemFri...	N	lld:chembl
chemicalCompound:399899	chemicalCompound:acdMostApk...	9.832	lld:chembl
chemicalCompound:399899	chemicalCompound:acdLogP	1.354	lld:chembl
chemicalCompound:399899	chemicalCompound:acdLogD	1.353	lld:chembl
chemicalCompound:399899	chemicalCompound:molecularS...	molecularSpecies:NEUTRAL	lld:chembl
chemicalCompound:399899	chemicalCompound:fullMwt	215.251	lld:chembl
chemicalCompound:399899	chemicalCompound:acdMostBpk...	3.387	lld:chembl
chemicalCompound:399899	chemicalCompound:chemblId	CHEMBL235821	lld:chembl
chemicalCompound:399899	chemicalCompound:maxPhase	0	lld:chembl
chemicalCompound:399899	chemicalCompound:therapeuti...	0	lld:chembl
chemicalCompound:399899	chemicalCompound:dosedIngre...	No	lld:chembl
chemicalCompound:399899	chemicalCompound:structureT...	structureType:MOL	lld:chembl
chemicalCompound:399899	chemicalCompound:chebi	https://linkedlifedata.com/...	lld:chembl
chemicalCompound:399899	chemicalCompound:moleculeTy...	moleculeType:Small molecule	lld:chembl
chemicalCompound:399899	chemicalCompound:oral	No	lld:chembl
chemicalCompound:399899	chemicalCompound:parenteral	No	lld:chembl
chemicalCompound:399899	chemicalCompound:topical	No	lld:chembl
chemicalCompound:399899	chemicalCompound:blackBoxWa...	No	lld:chembl
chemicalCompound:399899	chemicalCompound:naturalPro...	No	lld:chembl
chemicalCompound:399899	chemicalCompound:proDrug	No	lld:chembl
chemicalCompound:399899	chemicalCompound:activity	activity:2005787	lld:chembl
chemicalCompound:399899	chemicalCompound:activity	activity:2005788	lld:chembl
chemicalCompound:399899	chemicalCompound:activity	activity:2005789	lld:chembl
chemicalCompound:399899	chemicalCompound:activity	activity:2005814	lld:chembl
http://linkedlifedata.com/r...	http://linkedlifedata.com/r...	chemicalCompound:399899	lld:chembl
http://linkedlifedata.com/r...	http://linkedlifedata.com/r...	chemicalCompound:399899	lld:chembl