19211

Source:http://linkedlifedata.com/resource/chembl/compound/19211

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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/C11H12N2S/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10/h1-5,10H,6-8H2
chemicalCompound:standardIn...	HLFSDGLLUJUHTE-UHFFFAOYSA-N
chemicalCompound:canonicalS...	C1CN2CC(N=C2S1)c3ccccc3
chemicalCompound:molecularF...	C11H12N2S
chemicalCompound:moleculeId	19211
chemicalCompound:mwFreebase	204.291
chemicalCompound:alogp	2.29
chemicalCompound:hba	3
chemicalCompound:hbd	0
chemicalCompound:psa	40.9
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.84
chemicalCompound:acdLogD	-0.063
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	204.291
chemicalCompound:acdMostBpk...	9.995
chemicalCompound:chemblId	CHEMBL277775
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:119211
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:5345515, activity:5714602, activity:5775069, activity:5778203, activity:6789948, activity:7477351, activity:7490094, activity:7520022