1323609

Source:http://linkedlifedata.com/resource/chembl/compound/1323609

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:10010
chemicalCompound:standardIn...	InChI=1S/C3H6N2S.BrH/c6-3-4-1-2-5-3;/h1-2H2,(H2,4,5,6);1H
chemicalCompound:standardIn...	BADBZEULTRZERS-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Br.S=C1NCCN1
chemicalCompound:molecularF...	C3H7BrN2S
chemicalCompound:moleculeId	1323609
chemicalCompound:mwFreebase	102.158
chemicalCompound:alogp	0.476
chemicalCompound:hba	1
chemicalCompound:hbd	2
chemicalCompound:psa	56.15
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	-0.66
chemicalCompound:acdLogD	-0.66
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	183.07
chemicalCompound:acdMostBpk...	2.091
chemicalCompound:chemblId	CHEMBL2002318
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1423609
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:8246930, activity:8297946, activity:8397484, activity:8438753, activity:8472397, activity:8509782, activity:8557361, activity:8631301, activity:8633886, activity:8654556, activity:8747376, activity:8844388, activity:8851463, activity:8895955, activity:8959439, activity:9001165, activity:9038709, activity:9055387, activity:9096355, activity:9155936, activity:9176602, activity:9178021, activity:9269117, activity:9289132, activity:9319442, activity:9348886, activity:9416518, activity:9418351, activity:9493039, activity:9562191, activity:9663933, activity:9713516, activity:9720163, activity:9835871, activity:9855756, activity:9927256, activity:9964178, activity:10026123, activity:10053399, activity:10105976, activity:10134507, activity:10247093, activity:10266790, activity:10332486, activity:10374441, activity:10491266, activity:10509741, activity:10510887, activity:10577000, activity:10579917, activity:10653322, activity:10697229, activity:10743268, activity:10790515