831978

Source:http://linkedlifedata.com/resource/chembl/compound/831978

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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/C10H8ClN3OS/c11-7-2-1-3-8(6-7)13-9(15)14-10-12-4-5-16-10/h1-6H,(H2,12,13,14,15)
chemicalCompound:standardIn...	YJCQYEFUYHEVTJ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Clc1cccc(NC(=O)Nc2nccs2)c1
chemicalCompound:molecularF...	C10H8ClN3OS
chemicalCompound:moleculeId	831978
chemicalCompound:mwFreebase	253.708
chemicalCompound:alogp	2.184
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	82.26
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	6.182
chemicalCompound:acdLogP	2.593
chemicalCompound:acdLogD	0.868
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	253.708
chemicalCompound:acdMostBpk...	3.064
chemicalCompound:chemblId	CHEMBL1408094
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:931978
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:3633377, activity:3832533, activity:3834296, activity:3956033, activity:3963233, activity:4185403, activity:4210566, activity:4336958, activity:4359314, activity:4387867, activity:4430946, activity:4526934, activity:4541326, activity:4686474, activity:4736037, activity:4928227, activity:4988717, activity:5018758, activity:5019808, activity:5427496, activity:5529635, activity:5870453, activity:5945010, activity:6425058, activity:6433964, activity:6592706, activity:6638077, activity:6688955, activity:6729892, activity:6999748, activity:7083976, activity:7169382, activity:7279578, activity:7369974, activity:7380302, activity:7380929