109836

Source:http://linkedlifedata.com/resource/chembl/compound/109836

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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/C10H16N2O2/c1-7(2)13-10-8-6-11-5-3-4-9(8)14-12-10/h7,11H,3-6H2,1-2H3
chemicalCompound:standardIn...	XTTVTDWUFDGHOL-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)Oc1noc2CCCNCc12
chemicalCompound:molecularF...	C10 H16 N2 O2
chemicalCompound:moleculeId	109836
chemicalCompound:mwFreebase	196.246
chemicalCompound:alogp	1.471
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	47.29
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.32
chemicalCompound:acdLogD	0.857
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	196.246
chemicalCompound:acdMostBpk...	7.68
chemicalCompound:chemblId	CHEMBL305264
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:209836
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:485121, activity:485122, activity:485123, activity:485124, activity:485125, activity:485126, activity:485127, activity:485128, activity:485129