84806

Source:http://linkedlifedata.com/resource/chembl/compound/84806

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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/C6H13NO2/c1-2-3-4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1
chemicalCompound:standardIn...	LRQKBLKVPFOOQJ-YFKPBYRVSA-N
chemicalCompound:canonicalS...	CCCC[C@H](N)C(=O)O
chemicalCompound:molecularF...	C6H13NO2
chemicalCompound:moleculeId	84806
chemicalCompound:mwFreebase	131.173
chemicalCompound:alogp	-1.725
chemicalCompound:hba	3
chemicalCompound:hbd	2
chemicalCompound:psa	63.32
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	2.545
chemicalCompound:acdLogP	0.955
chemicalCompound:acdLogD	-1.547
chemicalCompound:molecularS...	molecularSpecies:ZWITTERION
chemicalCompound:fullMwt	131.173
chemicalCompound:acdMostBpk...	9.871
chemicalCompound:chemblId	CHEMBL292439
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:184806
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	NORLEUCINE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:18347
chemicalCompound:activity	activity:250268, activity:250269, activity:800755