1033983

Source:http://linkedlifedata.com/resource/chembl/compound/1033983

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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/C13H12N4O2S/c1-17-9-4-2-3-5-10(9)20-13(17)14-12(19)8-6-7-11(18)16-15-8/h2-5H,6-7H2,1H3,(H,16,18)
chemicalCompound:standardIn...	UAJGIYCHDCFSON-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CN1C(=NC(=O)C2=NNC(=O)CC2)Sc3ccccc13
chemicalCompound:molecularF...	C13H12N4O2S
chemicalCompound:moleculeId	1033983
chemicalCompound:mwFreebase	288.325
chemicalCompound:alogp	1.504
chemicalCompound:hba	6
chemicalCompound:hbd	1
chemicalCompound:psa	99.43
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	12.479
chemicalCompound:acdLogP	1.287
chemicalCompound:acdLogD	1.287
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	288.325
chemicalCompound:chemblId	CHEMBL1610099
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1133983
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:3645183, activity:3684328, activity:3815531, activity:4240349, activity:4672016, activity:4741562, activity:4883314, activity:4948002, activity:4966185, activity:5403412, activity:5479708, activity:5673493, activity:5940401, activity:6688349, activity:7120529, activity:7372837