195839

Source:http://linkedlifedata.com/resource/chembl/compound/195839

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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/C6H6N4S/c1-4-5-7-2-8-6(11)10(5)3-9-4/h2-3H,1H3,(H,7,8,11)
chemicalCompound:standardIn...	IZEXPTLOJHMTQV-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1ncn2c(S)ncnc12
chemicalCompound:molecularF...	C6 H6 N4 S
chemicalCompound:moleculeId	195839
chemicalCompound:mwFreebase	166.204
chemicalCompound:alogp	1
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	81.88
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	-2.605
chemicalCompound:acdLogP	0.393
chemicalCompound:acdLogD	-2.107
chemicalCompound:molecularS...	molecularSpecies:ZWITTERION
chemicalCompound:fullMwt	166.204
chemicalCompound:acdMostBpk...	10.133
chemicalCompound:chemblId	CHEMBL118465
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:295839
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:825652, activity:825653, activity:825654, activity:825655, activity:825656, activity:825657, activity:825658, activity:825659