906859

Source:http://linkedlifedata.com/resource/chembl/compound/906859

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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/C19H19F3N6O4S3/c1-7-4-11(19(20,21)22)26-28(7)8(2)14(29)23-12-15(30)27-13(17(31)32)10(5-33-16(12)27)6-34-18-25-24-9(3)35-18/h4,8,12,16H,5-6H2,1-3H3,(H,23,29)(H,31,32)
chemicalCompound:standardIn...	PQWDWFMGUGKHFZ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C(=O)NC1C2SCC(=C(N2C1=O)C(=O)O)CSc3nnc(C)s3)n4nc(cc4C)C(F)(F)F
chemicalCompound:molecularF...	C19H19F3N6O4S3
chemicalCompound:moleculeId	906859
chemicalCompound:mwFreebase	548.582
chemicalCompound:alogp	2.007
chemicalCompound:hba	9
chemicalCompound:hbd	2
chemicalCompound:psa	209.14
chemicalCompound:rtb	8
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	2.607
chemicalCompound:acdLogP	0.564
chemicalCompound:acdLogD	-3.153
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	548.582
chemicalCompound:chemblId	CHEMBL1482975
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1006859
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:3633158, activity:3723021, activity:3763447, activity:3769259, activity:3796624, activity:3929821, activity:4039049, activity:4176282, activity:4320593, activity:4373015, activity:4597846, activity:4885611, activity:5063448, activity:5390743, activity:5540255, activity:5600110, activity:5725817, activity:5812292, activity:6820029, activity:6981524, activity:7222508