785

Source:http://linkedlifedata.com/resource/chembl/compound/785

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Named Graph Language Inference

Statements in which the resource exists.
Subject	Predicate	Object	Context
chemicalCompound:785	chemicalCompound:standardIn...	InChI=1S/C13H16N4O/c1-18-11-4-2-3-10-13(11)15-9-12(16-10)17-7-5-14-6-8-17/h2-4,9,14H,5-8H2,1H3	lld:chembl
chemicalCompound:785	chemicalCompound:standardIn...	MWGKSPVQRPREIR-UHFFFAOYSA-N	lld:chembl
chemicalCompound:785	chemicalCompound:canonicalS...	COc1cccc2nc(cnc12)N3CCNCC3	lld:chembl
chemicalCompound:785	chemicalCompound:molecularF...	C13H16N4O	lld:chembl
chemicalCompound:785	chemicalCompound:moleculeId	785	lld:chembl
chemicalCompound:785	chemicalCompound:mwFreebase	244.292	lld:chembl
chemicalCompound:785	chemicalCompound:alogp	1.4	lld:chembl
chemicalCompound:785	chemicalCompound:hba	5	lld:chembl
chemicalCompound:785	chemicalCompound:hbd	1	lld:chembl
chemicalCompound:785	chemicalCompound:psa	50.28	lld:chembl
chemicalCompound:785	chemicalCompound:rtb	2	lld:chembl
chemicalCompound:785	chemicalCompound:ro3Pass	N	lld:chembl
chemicalCompound:785	chemicalCompound:numRo5viol...	0	lld:chembl
chemicalCompound:785	chemicalCompound:medChemFri...	Y	lld:chembl
chemicalCompound:785	chemicalCompound:acdLogP	0.924	lld:chembl
chemicalCompound:785	chemicalCompound:acdLogD	0.013	lld:chembl
chemicalCompound:785	chemicalCompound:molecularS...	molecularSpecies:NEUTRAL	lld:chembl
chemicalCompound:785	chemicalCompound:fullMwt	244.292	lld:chembl
chemicalCompound:785	chemicalCompound:acdMostBpk...	8.286	lld:chembl
chemicalCompound:785	chemicalCompound:chemblId	CHEMBL441329	lld:chembl
chemicalCompound:785	chemicalCompound:maxPhase	0	lld:chembl
chemicalCompound:785	chemicalCompound:therapeuti...	0	lld:chembl
chemicalCompound:785	chemicalCompound:dosedIngre...	No	lld:chembl
chemicalCompound:785	chemicalCompound:structureT...	structureType:MOL	lld:chembl
chemicalCompound:785	chemicalCompound:chebi	https://linkedlifedata.com/...	lld:chembl
chemicalCompound:785	chemicalCompound:moleculeTy...	moleculeType:Small molecule	lld:chembl
chemicalCompound:785	chemicalCompound:oral	No	lld:chembl
chemicalCompound:785	chemicalCompound:parenteral	No	lld:chembl
chemicalCompound:785	chemicalCompound:topical	No	lld:chembl
chemicalCompound:785	chemicalCompound:blackBoxWa...	No	lld:chembl
chemicalCompound:785	chemicalCompound:naturalPro...	No	lld:chembl
chemicalCompound:785	chemicalCompound:proDrug	No	lld:chembl
chemicalCompound:1122496	chemicalCompound:parent	chemicalCompound:785	lld:chembl