556312

Source:http://linkedlifedata.com/resource/chembl/compound/556312

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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/C7H9NOS3/c1-10-6-11-12-7-4-2-3-5-8(7)9/h2-5H,6H2,1H3
chemicalCompound:standardIn...	MUHWXZGNCHKLDY-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CSCSSc1cccc[n+]1[O-]
chemicalCompound:molecularF...	C7H9NOS3
chemicalCompound:moleculeId	556312
chemicalCompound:mwFreebase	219.347
chemicalCompound:alogp	2.102
chemicalCompound:hba	4
chemicalCompound:hbd	0
chemicalCompound:psa	101.36
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	0.111
chemicalCompound:acdLogD	0.111
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	219.347
chemicalCompound:chemblId	CHEMBL559906
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:656312
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:2663326, activity:2663327, activity:2663328, activity:2663329, activity:2663330, activity:2663331, activity:2663332, activity:2663405, activity:2663406, activity:2663421, activity:2663427, activity:2663428, activity:2663429, activity:2663430, activity:2663431