15590

Source:http://linkedlifedata.com/resource/chembl/compound/15590

Download in:

Named Graph Language Inference

Statements in which the resource exists.
Subject	Predicate	Object	Context
chemicalCompound:15590	rdf:type	chembl:ChemicalCompound	lld:chembl
chemicalCompound:15590	chemicalCompound:standardIn...	InChI=1S/C16H21N3O2/c1-13(19-9-8-17-12-19)15-6-4-5-7-16(15)21-11-14(20)10-18(2)3/h4-9,12,14,20H,1,10-11H2,2-3H3	lld:chembl
chemicalCompound:15590	chemicalCompound:standardIn...	UKKWCLWCSWTKLJ-UHFFFAOYSA-N	lld:chembl
chemicalCompound:15590	chemicalCompound:canonicalS...	CN(C)CC(O)COc1ccccc1C(=C)n2ccnc2	lld:chembl
chemicalCompound:15590	chemicalCompound:molecularF...	C16 H21 N3 O2	lld:chembl
chemicalCompound:15590	chemicalCompound:moleculeId	15590	lld:chembl
chemicalCompound:15590	chemicalCompound:mwFreebase	287.357	lld:chembl
chemicalCompound:15590	chemicalCompound:alogp	1.367	lld:chembl
chemicalCompound:15590	chemicalCompound:hba	4	lld:chembl
chemicalCompound:15590	chemicalCompound:hbd	1	lld:chembl
chemicalCompound:15590	chemicalCompound:psa	50.52	lld:chembl
chemicalCompound:15590	chemicalCompound:rtb	7	lld:chembl
chemicalCompound:15590	chemicalCompound:ro3Pass	N	lld:chembl
chemicalCompound:15590	chemicalCompound:numRo5viol...	0	lld:chembl
chemicalCompound:15590	chemicalCompound:medChemFri...	Y	lld:chembl
chemicalCompound:15590	chemicalCompound:acdMostApk...	13.928	lld:chembl
chemicalCompound:15590	chemicalCompound:acdLogP	1.681	lld:chembl
chemicalCompound:15590	chemicalCompound:acdLogD	0.573	lld:chembl
chemicalCompound:15590	chemicalCompound:molecularS...	molecularSpecies:BASE	lld:chembl
chemicalCompound:15590	chemicalCompound:fullMwt	287.357	lld:chembl
chemicalCompound:15590	chemicalCompound:acdMostBpk...	8.684	lld:chembl
chemicalCompound:15590	chemicalCompound:chemblId	CHEMBL15311	lld:chembl
chemicalCompound:15590	chemicalCompound:maxPhase	0	lld:chembl
chemicalCompound:15590	chemicalCompound:therapeuti...	0	lld:chembl
chemicalCompound:15590	chemicalCompound:dosedIngre...	No	lld:chembl
chemicalCompound:15590	chemicalCompound:structureT...	structureType:MOL	lld:chembl
chemicalCompound:15590	chemicalCompound:chebi	https://linkedlifedata.com/...	lld:chembl
chemicalCompound:15590	chemicalCompound:moleculeTy...	moleculeType:Small molecule	lld:chembl
chemicalCompound:15590	chemicalCompound:oral	No	lld:chembl
chemicalCompound:15590	chemicalCompound:parenteral	No	lld:chembl
chemicalCompound:15590	chemicalCompound:topical	No	lld:chembl
chemicalCompound:15590	chemicalCompound:blackBoxWa...	No	lld:chembl
chemicalCompound:15590	chemicalCompound:naturalPro...	No	lld:chembl
chemicalCompound:15590	chemicalCompound:proDrug	No	lld:chembl
chemicalCompound:15590	chemicalCompound:activity	activity:72976	lld:chembl
chemicalCompound:15590	chemicalCompound:activity	activity:72977	lld:chembl
chemicalCompound:15590	chemicalCompound:activity	activity:72978	lld:chembl
chemicalCompound:15590	chemicalCompound:activity	activity:72979	lld:chembl
chemicalCompound:15590	chemicalCompound:activity	activity:72980	lld:chembl
chemicalCompound:15590	chemicalCompound:activity	activity:72981	lld:chembl
http://linkedlifedata.com/r...	http://linkedlifedata.com/r...	chemicalCompound:15590	lld:chembl