470103

Source:http://linkedlifedata.com/resource/chembl/compound/470103

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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/C13H14O2S/c1-2-3-9-6-7-16-13(9)10-4-5-11(14)12(15)8-10/h4-8,14-15H,2-3H2,1H3
chemicalCompound:standardIn...	MPNXAAIOTWZBKL-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCc1ccsc1c2ccc(O)c(O)c2
chemicalCompound:molecularF...	C13H14O2S
chemicalCompound:moleculeId	470103
chemicalCompound:mwFreebase	234.314
chemicalCompound:alogp	4.216
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	68.7
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.329
chemicalCompound:acdLogP	3.948
chemicalCompound:acdLogD	3.939
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	234.314
chemicalCompound:chemblId	CHEMBL494307
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:570103
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:2363689, activity:2363708, activity:2363727, activity:2363752, activity:2363753, activity:2363790, activity:2363791, activity:2363827, activity:2363828, activity:2363865, activity:2363866, activity:3245988, activity:6289744, activity:6289751, activity:6289758, activity:6289765, activity:6289772, activity:6289779, activity:6289786