711

Source:http://linkedlifedata.com/resource/chembl/compound/711

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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/C11H10N2O/c1-2-4-9-8(3-1)7-10(14-9)11-12-5-6-13-11/h1-4,7H,5-6H2,(H,12,13)
chemicalCompound:standardIn...	YTJOHEUHUVBKSB-UHFFFAOYSA-N
chemicalCompound:canonicalS...	C1CN=C(N1)c2oc3ccccc3c2
chemicalCompound:molecularF...	C11H10N2O
chemicalCompound:moleculeId	711
chemicalCompound:mwFreebase	186.21
chemicalCompound:alogp	1.712
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	37.53
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.477
chemicalCompound:acdLogD	0.703
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	186.21
chemicalCompound:acdMostBpk...	9.557
chemicalCompound:chemblId	CHEMBL404505
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:100711
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:129788, activity:637307, activity:637308, activity:809085, activity:866361, activity:866362, activity:866363, activity:897360, activity:897361, activity:897362, activity:2618849, activity:2618850, activity:2618851, activity:2618859, activity:2618860, activity:2618861, activity:3466364, activity:3466377, activity:3466390, activity:3466403, activity:3466416, activity:3713709, activity:3742244, activity:3780481, activity:4171153, activity:4792939, activity:5002396, activity:5995092, activity:6006454, activity:6036019, activity:6036932, activity:6064225