486266

Source:http://linkedlifedata.com/resource/chembl/compound/486266

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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/C5H5NO2/c7-5(8)4-2-1-3-6-4/h1-3,6H,(H,7,8)
chemicalCompound:standardIn...	WRHZVMBBRYBTKZ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	OC(=O)c1ccc[nH]1
chemicalCompound:molecularF...	C5H5NO2
chemicalCompound:moleculeId	486266
chemicalCompound:mwFreebase	111.099
chemicalCompound:alogp	0.844
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	53.09
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	4.41
chemicalCompound:acdLogP	0.85
chemicalCompound:acdLogD	-2.098
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	111.099
chemicalCompound:chemblId	CHEMBL509027
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:586266
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:36751
chemicalCompound:activity	activity:2338131, activity:5193018, activity:5193033, activity:5193454, activity:5193715, activity:5193745, activity:5194155, activity:5194164, activity:5194217, activity:5194365