654853

Source:http://linkedlifedata.com/resource/chembl/compound/654853

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:standardIn...	InChI=1S/C19H38N/c1-5-8-9-10-11-12-13-14-15-16-19-20(4,17-6-2)18-7-3/h6-7H,2-3,5,8-19H2,1,4H3/q+1
chemicalCompound:standardIn...	XODGXHBUNWQYGF-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCCCCCCCCC[N+](C)(CC=C)CC=C
chemicalCompound:molecularF...	C19H38N
chemicalCompound:moleculeId	654853
chemicalCompound:mwFreebase	280.512
chemicalCompound:alogp	5.177
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	0
chemicalCompound:rtb	15
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	0.987
chemicalCompound:acdLogD	0.987
chemicalCompound:fullMwt	280.512
chemicalCompound:chemblId	CHEMBL1180903
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:754853
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No