238109

Source:http://linkedlifedata.com/resource/chembl/compound/238109

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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/C14H14N2OS/c1-2-4-13(17-9-14-15-6-7-16-14)12(3-1)11-5-8-18-10-11/h1-5,8,10H,6-7,9H2,(H,15,16)
chemicalCompound:standardIn...	IVWFVGKPGDSCOS-UHFFFAOYSA-N
chemicalCompound:canonicalS...	C(Oc1ccccc1c2ccsc2)C3=NCCN3
chemicalCompound:molecularF...	C14 H14 N2 O S
chemicalCompound:moleculeId	238109
chemicalCompound:mwFreebase	258.339
chemicalCompound:alogp	2.132
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	61.86
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.861
chemicalCompound:acdLogD	1
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	258.339
chemicalCompound:acdMostBpk...	9.816
chemicalCompound:chemblId	CHEMBL422477
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:338109
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:467214, activity:467215, activity:467216, activity:467217, activity:467218, activity:467219