5659

Source:http://linkedlifedata.com/resource/chembl/compound/5659

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:5659_MK-417_RESEARCH_CODE, synonym:5659_MK-927_RESEARCH_CODE
chemicalCompound:standardIn...	InChI=1S/C11H18N2O4S3/c1-7(2)6-13-9-3-4-19(14,15)11-8(9)5-10(18-11)20(12,16)17/h5,7,9,13H,3-4,6H2,1-2H3,(H2,12,16,17)/t9-/m0/s1
chemicalCompound:standardIn...	JFLUCCKXAYBETQ-VIFPVBQESA-N
chemicalCompound:canonicalS...	CC(C)CN[C@H]1CCS(=O)(=O)c2sc(cc12)S(=O)(=O)N
chemicalCompound:molecularF...	C11 H18 N2 O4 S3
chemicalCompound:moleculeId	5659
chemicalCompound:mwFreebase	338.467
chemicalCompound:alogp	0.611
chemicalCompound:hba	5
chemicalCompound:hbd	2
chemicalCompound:psa	151.33
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.423
chemicalCompound:acdLogP	2
chemicalCompound:acdLogD	1.856
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	338.467
chemicalCompound:acdMostBpk...	6.907
chemicalCompound:chemblId	CHEMBL417975
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:105659
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	MK-927
chemicalCompound:activity	activity:93761, activity:93762, activity:93763, activity:630633, activity:630634, activity:630635, activity:630636, activity:630637, activity:630638, activity:630639, activity:1172382, activity:1172383, activity:1172384