653956

Source:http://linkedlifedata.com/resource/chembl/compound/653956

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:standardIn...	InChI=1S/C20H44N/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21(6-2,7-3)8-4/h5-20H2,1-4H3/q+1
chemicalCompound:standardIn...	JXCCIZBMTUFJKN-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCCCCCCCCCCC[N+](CC)(CC)CC
chemicalCompound:molecularF...	C20H44N
chemicalCompound:moleculeId	653956
chemicalCompound:mwFreebase	298.57
chemicalCompound:alogp	5.902
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	0
chemicalCompound:rtb	16
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	0.974
chemicalCompound:acdLogD	0.974
chemicalCompound:fullMwt	298.57
chemicalCompound:chemblId	CHEMBL1180006
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:753956
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No