1310417

Source:http://linkedlifedata.com/resource/chembl/compound/1310417

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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/C16H24N6O3/c1-16(2,3)25-15(23)22(24)8-4-7-21-10-19-12-13(20-11-5-6-11)17-9-18-14(12)21/h9-11,24H,4-8H2,1-3H3,(H,17,18,20)
chemicalCompound:standardIn...	YCVSJYRIFZPRES-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)(C)OC(=O)N(O)CCCn1cnc2c(NC3CC3)ncnc12
chemicalCompound:molecularF...	C16H24N6O3
chemicalCompound:moleculeId	1310417
chemicalCompound:mwFreebase	348.4
chemicalCompound:alogp	1.651
chemicalCompound:hba	7
chemicalCompound:hbd	2
chemicalCompound:psa	105.4
chemicalCompound:rtb	8
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.017
chemicalCompound:acdLogP	1.846
chemicalCompound:acdLogD	1.836
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	348.4
chemicalCompound:acdMostBpk...	3.911
chemicalCompound:chemblId	CHEMBL1989126
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1410417
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:8243632, activity:8254033, activity:8303616, activity:8318771, activity:8404665, activity:8424803, activity:8482214, activity:8524271, activity:8580631, activity:8600951, activity:8661642, activity:8681966, activity:8772575, activity:8779366, activity:8809247, activity:8856938, activity:8907840, activity:8928424, activity:8971334, activity:9070719, activity:9076270, activity:9099339, activity:9101579, activity:9192702, activity:9236708, activity:9292018, activity:9297656, activity:9360532, activity:9370921, activity:9443567, activity:9454638, activity:9521850, activity:9691652, activity:9705849, activity:9716287, activity:9796098, activity:9867282, activity:9896254, activity:9929947, activity:9967812, activity:10029050, activity:10040344, activity:10085052, activity:10153041, activity:10176620, activity:10217344, activity:10254205, activity:10261075, activity:10276611, activity:10372814, activity:10402177, activity:10446545, activity:10498329, activity:10595436, activity:10606819, activity:10621716, activity:10704570, activity:10724700, activity:10797465