654873

Source:http://linkedlifedata.com/resource/chembl/compound/654873

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:standardIn...	InChI=1S/C17H34N/c1-5-7-8-9-10-11-12-13-14-15-17-18(3,4)16-6-2/h2H,5,7-17H2,1,3-4H3/q+1
chemicalCompound:standardIn...	XSJWTEZTQHSADD-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCCCCCCCCC[N+](C)(C)CC#C
chemicalCompound:molecularF...	C17H34N
chemicalCompound:moleculeId	654873
chemicalCompound:mwFreebase	252.459
chemicalCompound:alogp	5.135
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	0
chemicalCompound:rtb	12
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	0.771
chemicalCompound:acdLogD	0.771
chemicalCompound:fullMwt	252.459
chemicalCompound:chemblId	CHEMBL1180923
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:754873
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No