472397

Source:http://linkedlifedata.com/resource/chembl/compound/472397

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Named Graph Language Inference

Statements in which the resource exists.
Subject	Predicate	Object	Context
chemicalCompound:472397	rdf:type	chembl:ChemicalCompound	lld:chembl
chemicalCompound:472397	chemicalCompound:standardIn...	InChI=1S/C18H25ClN4O/c1-3-23(4-2)12-8-18(24)22-11-10-21-16-7-9-20-17-13-14(19)5-6-15(16)17/h5-7,9,13H,3-4,8,10-12H2,1-2H3,(H,20,21)(H,22,24)	lld:chembl
chemicalCompound:472397	chemicalCompound:standardIn...	YFDBFXYVTRWXAE-UHFFFAOYSA-N	lld:chembl
chemicalCompound:472397	chemicalCompound:canonicalS...	CCN(CC)CCC(=O)NCCNc1ccnc2cc(Cl)ccc12	lld:chembl
chemicalCompound:472397	chemicalCompound:molecularF...	C18H25ClN4O	lld:chembl
chemicalCompound:472397	chemicalCompound:moleculeId	472397	lld:chembl
chemicalCompound:472397	chemicalCompound:mwFreebase	348.87	lld:chembl
chemicalCompound:472397	chemicalCompound:alogp	2.633	lld:chembl
chemicalCompound:472397	chemicalCompound:hba	4	lld:chembl
chemicalCompound:472397	chemicalCompound:hbd	2	lld:chembl
chemicalCompound:472397	chemicalCompound:psa	57.26	lld:chembl
chemicalCompound:472397	chemicalCompound:rtb	9	lld:chembl
chemicalCompound:472397	chemicalCompound:ro3Pass	N	lld:chembl
chemicalCompound:472397	chemicalCompound:numRo5viol...	0	lld:chembl
chemicalCompound:472397	chemicalCompound:medChemFri...	Y	lld:chembl
chemicalCompound:472397	chemicalCompound:acdLogP	2.568	lld:chembl
chemicalCompound:472397	chemicalCompound:acdLogD	0.317	lld:chembl
chemicalCompound:472397	chemicalCompound:molecularS...	molecularSpecies:BASE	lld:chembl
chemicalCompound:472397	chemicalCompound:fullMwt	348.87	lld:chembl
chemicalCompound:472397	chemicalCompound:acdMostBpk...	9.815	lld:chembl
chemicalCompound:472397	chemicalCompound:chemblId	CHEMBL465989	lld:chembl
chemicalCompound:472397	chemicalCompound:maxPhase	0	lld:chembl
chemicalCompound:472397	chemicalCompound:therapeuti...	0	lld:chembl
chemicalCompound:472397	chemicalCompound:dosedIngre...	No	lld:chembl
chemicalCompound:472397	chemicalCompound:structureT...	structureType:MOL	lld:chembl
chemicalCompound:472397	chemicalCompound:chebi	https://linkedlifedata.com/...	lld:chembl
chemicalCompound:472397	chemicalCompound:moleculeTy...	moleculeType:Small molecule	lld:chembl
chemicalCompound:472397	chemicalCompound:oral	No	lld:chembl
chemicalCompound:472397	chemicalCompound:parenteral	No	lld:chembl
chemicalCompound:472397	chemicalCompound:topical	No	lld:chembl
chemicalCompound:472397	chemicalCompound:blackBoxWa...	No	lld:chembl
chemicalCompound:472397	chemicalCompound:naturalPro...	No	lld:chembl
chemicalCompound:472397	chemicalCompound:proDrug	No	lld:chembl
chemicalCompound:472397	chemicalCompound:activity	activity:2266894	lld:chembl
chemicalCompound:472397	chemicalCompound:activity	activity:2266945	lld:chembl
chemicalCompound:472397	chemicalCompound:activity	activity:2266993	lld:chembl
chemicalCompound:472397	chemicalCompound:activity	activity:3062605	lld:chembl
chemicalCompound:472397	chemicalCompound:activity	activity:3062628	lld:chembl
chemicalCompound:472397	chemicalCompound:activity	activity:3062651	lld:chembl
http://linkedlifedata.com/r...	http://linkedlifedata.com/r...	chemicalCompound:472397	lld:chembl
http://linkedlifedata.com/r...	http://linkedlifedata.com/r...	chemicalCompound:472397	lld:chembl