226879

Source:http://linkedlifedata.com/resource/chembl/compound/226879

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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/C8H19BrN/c1-10(2,3)8-6-4-5-7-9/h4-8H2,1-3H3/q+1
chemicalCompound:standardIn...	YOSALHKHPBALIO-UHFFFAOYSA-N
chemicalCompound:canonicalS...	C[N+](C)(C)CCCCCBr
chemicalCompound:molecularF...	C8 H19 Br N
chemicalCompound:moleculeId	226879
chemicalCompound:mwFreebase	209.147
chemicalCompound:alogp	0.873
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	0
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	-2.297
chemicalCompound:acdLogD	-2.297
chemicalCompound:fullMwt	209.147
chemicalCompound:chemblId	CHEMBL344196
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:326879
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:1087149