1308203

Source:http://linkedlifedata.com/resource/chembl/compound/1308203

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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:1329336
chemicalCompound:standardIn...	InChI=1S/C9H16O8S.Na/c1-2-3-16-9-8(12)7(11)6(10)5(17-9)4-18(13,14)15;/h2,5-12H,1,3-4H2,(H,13,14,15);/q;+1
chemicalCompound:standardIn...	XQEFRUUODQPSLV-UHFFFAOYSA-N
chemicalCompound:canonicalS...	[Na+].OC1C(O)C(CS(=O)(=O)O)OC(OCC=C)C1O
chemicalCompound:molecularF...	C9H16NaO8S
chemicalCompound:moleculeId	1308203
chemicalCompound:mwFreebase	284.284
chemicalCompound:alogp	-1.544
chemicalCompound:hba	8
chemicalCompound:hbd	4
chemicalCompound:psa	141.89
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	1.402
chemicalCompound:acdLogP	-2.544
chemicalCompound:acdLogD	-6.043
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	307.273
chemicalCompound:chemblId	CHEMBL1986912
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1408203
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:8234513, activity:8245213, activity:8309862, activity:8395846, activity:8420206, activity:8477696, activity:8501999, activity:8571650, activity:8596271, activity:8673216, activity:8723290, activity:8763700, activity:8770479, activity:8800260, activity:8852320, activity:8898901, activity:8923690, activity:8966661, activity:9066136, activity:9067289, activity:9090611, activity:9092762, activity:9183765, activity:9283226, activity:9355895, activity:9359290, activity:9432685, activity:9445978, activity:9504481, activity:9517644, activity:9687238, activity:9701233, activity:9787644, activity:9858476, activity:9887465, activity:10024552, activity:10035881, activity:10076454, activity:10148561, activity:10167863, activity:10212729, activity:10245396, activity:10272168, activity:10321827, activity:10364077, activity:10466478, activity:10489543, activity:10590943, activity:10613138, activity:10667172, activity:10695764, activity:10715921, activity:10788824