1306140

Source:http://linkedlifedata.com/resource/chembl/compound/1306140

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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/C12H12N4S/c1-7-14-12-10(11-15-13-6-16(7)11)8-4-2-3-5-9(8)17-12/h6H,2-5H2,1H3
chemicalCompound:standardIn...	PONPELTUPXRSHB-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1nc2sc3CCCCc3c2c4nncn14
chemicalCompound:molecularF...	C12H12N4S
chemicalCompound:moleculeId	1306140
chemicalCompound:mwFreebase	244.315
chemicalCompound:alogp	2.397
chemicalCompound:hba	3
chemicalCompound:hbd	0
chemicalCompound:psa	71.31
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.601
chemicalCompound:acdLogD	2.601
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	244.315
chemicalCompound:acdMostBpk...	0.81
chemicalCompound:chemblId	CHEMBL1984849
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1406140
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:8781077, activity:9020204