7517

Source:http://linkedlifedata.com/resource/chembl/compound/7517

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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/C11H11NO3/c13-10-6-7-12(10)8-15-11(14)9-4-2-1-3-5-9/h1-5H,6-8H2
chemicalCompound:standardIn...	MOPCEVJKGGGRGI-UHFFFAOYSA-N
chemicalCompound:canonicalS...	O=C(OCN1CCC1=O)c2ccccc2
chemicalCompound:molecularF...	C11 H11 N O3
chemicalCompound:moleculeId	7517
chemicalCompound:mwFreebase	205.21
chemicalCompound:alogp	1
chemicalCompound:hba	3
chemicalCompound:hbd	0
chemicalCompound:psa	46.61
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.222
chemicalCompound:acdLogD	1.222
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	205.21
chemicalCompound:chemblId	CHEMBL10421
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:107517
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:479953, activity:479954, activity:479955