822696

Source:http://linkedlifedata.com/resource/chembl/compound/822696

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Named Graph Language Inference

Statements in which the resource exists.
Subject	Predicate	Object	Context
chemicalCompound:822696	rdf:type	chembl:ChemicalCompound	lld:chembl
chemicalCompound:822696	chemicalCompound:standardIn...	InChI=1S/C12H14N4O3/c17-16(18)10-6-5-9(11-12(10)14-19-13-11)15-7-3-1-2-4-8-15/h5-6H,1-4,7-8H2	lld:chembl
chemicalCompound:822696	chemicalCompound:standardIn...	QXXDTEHNGZLGFT-UHFFFAOYSA-N	lld:chembl
chemicalCompound:822696	chemicalCompound:canonicalS...	[O-][N+](=O)c1ccc(N2CCCCCC2)c3nonc13	lld:chembl
chemicalCompound:822696	chemicalCompound:molecularF...	C12H14N4O3	lld:chembl
chemicalCompound:822696	chemicalCompound:moleculeId	822696	lld:chembl
chemicalCompound:822696	chemicalCompound:mwFreebase	262.265	lld:chembl
chemicalCompound:822696	chemicalCompound:alogp	2.829	lld:chembl
chemicalCompound:822696	chemicalCompound:hba	5	lld:chembl
chemicalCompound:822696	chemicalCompound:hbd	0	lld:chembl
chemicalCompound:822696	chemicalCompound:psa	87.98	lld:chembl
chemicalCompound:822696	chemicalCompound:rtb	2	lld:chembl
chemicalCompound:822696	chemicalCompound:ro3Pass	N	lld:chembl
chemicalCompound:822696	chemicalCompound:numRo5viol...	0	lld:chembl
chemicalCompound:822696	chemicalCompound:medChemFri...	N	lld:chembl
chemicalCompound:822696	chemicalCompound:acdLogP	3.638	lld:chembl
chemicalCompound:822696	chemicalCompound:acdLogD	3.638	lld:chembl
chemicalCompound:822696	chemicalCompound:molecularS...	molecularSpecies:NEUTRAL	lld:chembl
chemicalCompound:822696	chemicalCompound:fullMwt	262.265	lld:chembl
chemicalCompound:822696	chemicalCompound:chemblId	CHEMBL1398812	lld:chembl
chemicalCompound:822696	chemicalCompound:maxPhase	0	lld:chembl
chemicalCompound:822696	chemicalCompound:therapeuti...	0	lld:chembl
chemicalCompound:822696	chemicalCompound:dosedIngre...	No	lld:chembl
chemicalCompound:822696	chemicalCompound:structureT...	structureType:MOL	lld:chembl
chemicalCompound:822696	chemicalCompound:chebi	https://linkedlifedata.com/...	lld:chembl
chemicalCompound:822696	chemicalCompound:moleculeTy...	moleculeType:Small molecule	lld:chembl
chemicalCompound:822696	chemicalCompound:oral	No	lld:chembl
chemicalCompound:822696	chemicalCompound:parenteral	No	lld:chembl
chemicalCompound:822696	chemicalCompound:topical	No	lld:chembl
chemicalCompound:822696	chemicalCompound:blackBoxWa...	No	lld:chembl
chemicalCompound:822696	chemicalCompound:naturalPro...	No	lld:chembl
chemicalCompound:822696	chemicalCompound:proDrug	No	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:3606090	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:3619950	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:3735982	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:3768231	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:3804464	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:4337290	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:4541379	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:4733261	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:4745444	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:4914667	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:4986531	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:5344420	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:5397301	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:5501045	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:5513603	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:5567602	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:5580256	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:5656780	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:5794458	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:5853190	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:5865789	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:5959287	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:6728421	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:6733710	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:6808357	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:6842139	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:6992587	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:7033085	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:7251253	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:7279761	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:7337655	lld:chembl
chemicalCompound:822696	chemicalCompound:activity	activity:10543297	lld:chembl
http://linkedlifedata.com/r...	http://linkedlifedata.com/r...	chemicalCompound:822696	lld:chembl