28873

Source:http://linkedlifedata.com/resource/chembl/compound/28873

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Named Graph Language Inference

Statements in which the resource exists.
Subject	Predicate	Object	Context
chemicalCompound:28873	rdf:type	chembl:ChemicalCompound	lld:chembl
chemicalCompound:28873	chemicalCompound:standardIn...	InChI=1S/C9H11N3/c1-10-9-11-6-7-4-2-3-5-8(7)12-9/h2-5H,6H2,1H3,(H2,10,11,12)	lld:chembl
chemicalCompound:28873	chemicalCompound:standardIn...	HGWQCCCCLPPNRM-UHFFFAOYSA-N	lld:chembl
chemicalCompound:28873	chemicalCompound:canonicalS...	CNC1=NCc2ccccc2N1	lld:chembl
chemicalCompound:28873	chemicalCompound:molecularF...	C9 H11 N3	lld:chembl
chemicalCompound:28873	chemicalCompound:moleculeId	28873	lld:chembl
chemicalCompound:28873	chemicalCompound:mwFreebase	161.204	lld:chembl
chemicalCompound:28873	chemicalCompound:alogp	0.96	lld:chembl
chemicalCompound:28873	chemicalCompound:hba	3	lld:chembl
chemicalCompound:28873	chemicalCompound:hbd	2	lld:chembl
chemicalCompound:28873	chemicalCompound:psa	36.42	lld:chembl
chemicalCompound:28873	chemicalCompound:rtb	1	lld:chembl
chemicalCompound:28873	chemicalCompound:ro3Pass	Y	lld:chembl
chemicalCompound:28873	chemicalCompound:numRo5viol...	0	lld:chembl
chemicalCompound:28873	chemicalCompound:medChemFri...	Y	lld:chembl
chemicalCompound:28873	chemicalCompound:acdLogP	1.386	lld:chembl
chemicalCompound:28873	chemicalCompound:acdLogD	-0.598	lld:chembl
chemicalCompound:28873	chemicalCompound:molecularS...	molecularSpecies:BASE	lld:chembl
chemicalCompound:28873	chemicalCompound:fullMwt	161.204	lld:chembl
chemicalCompound:28873	chemicalCompound:acdMostBpk...	12.053	lld:chembl
chemicalCompound:28873	chemicalCompound:chemblId	CHEMBL25163	lld:chembl
chemicalCompound:28873	chemicalCompound:maxPhase	0	lld:chembl
chemicalCompound:28873	chemicalCompound:therapeuti...	0	lld:chembl
chemicalCompound:28873	chemicalCompound:dosedIngre...	No	lld:chembl
chemicalCompound:28873	chemicalCompound:structureT...	structureType:MOL	lld:chembl
chemicalCompound:28873	chemicalCompound:chebi	https://linkedlifedata.com/...	lld:chembl
chemicalCompound:28873	chemicalCompound:moleculeTy...	moleculeType:Small molecule	lld:chembl
chemicalCompound:28873	chemicalCompound:oral	No	lld:chembl
chemicalCompound:28873	chemicalCompound:parenteral	No	lld:chembl
chemicalCompound:28873	chemicalCompound:topical	No	lld:chembl
chemicalCompound:28873	chemicalCompound:blackBoxWa...	No	lld:chembl
chemicalCompound:28873	chemicalCompound:naturalPro...	No	lld:chembl
chemicalCompound:28873	chemicalCompound:proDrug	No	lld:chembl
chemicalCompound:28873	chemicalCompound:activity	activity:56593	lld:chembl
chemicalCompound:28873	chemicalCompound:activity	activity:56594	lld:chembl
chemicalCompound:28873	chemicalCompound:activity	activity:56595	lld:chembl
chemicalCompound:28873	chemicalCompound:activity	activity:56596	lld:chembl
chemicalCompound:28873	chemicalCompound:activity	activity:56597	lld:chembl
chemicalCompound:28873	chemicalCompound:activity	activity:56598	lld:chembl
chemicalCompound:28873	chemicalCompound:activity	activity:56599	lld:chembl
chemicalCompound:550243	chemicalCompound:parent	chemicalCompound:28873	lld:chembl
http://linkedlifedata.com/r...	http://linkedlifedata.com/r...	chemicalCompound:28873	lld:chembl