654148

Source:http://linkedlifedata.com/resource/chembl/compound/654148

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:standardIn...	InChI=1S/C16H35BrN/c1-4-5-6-7-8-9-10-11-12-13-15-18(2,3)16-14-17/h4-16H2,1-3H3/q+1
chemicalCompound:standardIn...	VPEUINYNEXONDG-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCCCCCCCCC[N+](C)(C)CCBr
chemicalCompound:molecularF...	C16H35BrN
chemicalCompound:moleculeId	654148
chemicalCompound:mwFreebase	321.36
chemicalCompound:alogp	4.753
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	0
chemicalCompound:rtb	13
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	0.807
chemicalCompound:acdLogD	0.807
chemicalCompound:fullMwt	321.36
chemicalCompound:chemblId	CHEMBL1180198
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:754148
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No