66232

Source:http://linkedlifedata.com/resource/chembl/compound/66232

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C5H13N/c1-3-5(2)4-6/h5H,3-4,6H2,1-2H3
chemicalCompound:standardIn...	VJROPLWGFCORRM-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCC(C)CN
chemicalCompound:molecularF...	C5 H13 N
chemicalCompound:moleculeId	66232
chemicalCompound:mwFreebase	87.1634
chemicalCompound:alogp	1
chemicalCompound:hba	1
chemicalCompound:hbd	1
chemicalCompound:psa	26.02
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.41
chemicalCompound:acdLogD	-1.497
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	87.1634
chemicalCompound:acdMostBpk...	10.75
chemicalCompound:chemblId	CHEMBL294955
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:166232
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:221107