1176400

Source:http://linkedlifedata.com/resource/chembl/compound/1176400

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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/C11H16N2O2/c1-15-8-10(12)11(14)13-7-9-5-3-2-4-6-9/h2-6,10H,7-8,12H2,1H3,(H,13,14)/t10-/m0/s1
chemicalCompound:standardIn...	WPLANNRKFDHEKD-JTQLQIEISA-N
chemicalCompound:canonicalS...	COC[C@H](N)C(=O)NCc1ccccc1
chemicalCompound:molecularF...	C11H16N2O2
chemicalCompound:moleculeId	1176400
chemicalCompound:mwFreebase	208.257
chemicalCompound:alogp	0
chemicalCompound:hba	3
chemicalCompound:hbd	2
chemicalCompound:psa	64.35
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	0.864
chemicalCompound:acdLogD	0.844
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	208.257
chemicalCompound:acdMostBpk...	6.467
chemicalCompound:chemblId	CHEMBL1828641
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1276400
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:6371038, activity:6371157, activity:6371162, activity:6371171, activity:6371188, activity:6371243