226006

Source:http://linkedlifedata.com/resource/chembl/compound/226006

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C17H25NO/c19-16-9-13-18(14-10-16)17(11-5-2-6-12-17)15-7-3-1-4-8-15/h1,3-4,7-8,16,19H,2,5-6,9-14H2
chemicalCompound:standardIn...	SLUMSLWGPLFKGY-UHFFFAOYSA-N
chemicalCompound:canonicalS...	OC1CCN(CC1)C2(CCCCC2)c3ccccc3
chemicalCompound:molecularF...	C17 H25 N O
chemicalCompound:moleculeId	226006
chemicalCompound:mwFreebase	259.387
chemicalCompound:alogp	3.05
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	23.47
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.792
chemicalCompound:acdLogD	2.432
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	259.387
chemicalCompound:acdMostBpk...	7.449
chemicalCompound:chemblId	CHEMBL422629
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:326006
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:450061, activity:450062, activity:450063, activity:450064, activity:450065, activity:473664, activity:473665, activity:473666, activity:473667, activity:473668, activity:473669, activity:491670, activity:491671, activity:491672, activity:491673, activity:491674