9061

Source:http://linkedlifedata.com/resource/chembl/compound/9061

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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/C9H13N/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8,10H2
chemicalCompound:standardIn...	LYUQWQRTDLVQGA-UHFFFAOYSA-N
chemicalCompound:canonicalS...	NCCCc1ccccc1
chemicalCompound:molecularF...	C9H13N
chemicalCompound:moleculeId	9061
chemicalCompound:mwFreebase	135.206
chemicalCompound:alogp	1.713
chemicalCompound:hba	1
chemicalCompound:hbd	1
chemicalCompound:psa	26.02
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.91
chemicalCompound:acdLogD	-0.77
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	135.206
chemicalCompound:acdMostBpk...	10.286
chemicalCompound:chemblId	CHEMBL276864
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:109061
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:217532, activity:217533, activity:217534, activity:217535, activity:217536, activity:217537, activity:232898, activity:905169, activity:1183402, activity:1183403, activity:1183404, activity:1190174, activity:1773583, activity:1773592, activity:1773627, activity:1773636