653950

Source:http://linkedlifedata.com/resource/chembl/compound/653950

Download in:

Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:standardIn...	InChI=1S/C19H42N/c1-5-7-8-9-10-11-12-13-14-15-16-17-19-20(3,4)18-6-2/h5-19H2,1-4H3/q+1
chemicalCompound:standardIn...	UOBWYWBNUXIGND-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCCCCCCCCCCC[N+](C)(C)CCC
chemicalCompound:molecularF...	C19H42N
chemicalCompound:moleculeId	653950
chemicalCompound:mwFreebase	284.543
chemicalCompound:alogp	5.728
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	0
chemicalCompound:rtb	15
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	1.264
chemicalCompound:acdLogD	1.264
chemicalCompound:fullMwt	284.543
chemicalCompound:chemblId	CHEMBL1180000
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:753950
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No