167938

Source:http://linkedlifedata.com/resource/chembl/compound/167938

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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/C5H9N5S/c1-9(2)5(11)10-4(6)7-3-8-10/h3H,1-2H3,(H2,6,7,8)
chemicalCompound:standardIn...	BBQKKTLRXXJQCJ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CN(C)C(=S)n1ncnc1N
chemicalCompound:molecularF...	C5 H9 N5 S
chemicalCompound:moleculeId	167938
chemicalCompound:mwFreebase	171.223
chemicalCompound:alogp	1
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	92.06
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	0.043
chemicalCompound:acdLogD	0.043
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	171.223
chemicalCompound:acdMostBpk...	2.012
chemicalCompound:chemblId	CHEMBL320675
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:267938
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:790348