370508

Source:http://linkedlifedata.com/resource/chembl/compound/370508

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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/C12H11F3N2O2/c13-12(14,15)19-9-3-1-2-7-8-6-16-4-5-17(8)11(18)10(7)9/h1-3,8,16H,4-6H2
chemicalCompound:standardIn...	QCDPKPGZFATVMP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	FC(F)(F)Oc1cccc2C3CNCCN3C(=O)c12
chemicalCompound:molecularF...	C12 H11 F3 N2 O2
chemicalCompound:moleculeId	370508
chemicalCompound:mwFreebase	272.223
chemicalCompound:alogp	2.567
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	41.57
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.862
chemicalCompound:acdLogD	1
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	272.223
chemicalCompound:acdMostBpk...	8.2
chemicalCompound:chemblId	CHEMBL219734
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:470508
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:1822441, activity:1822452, activity:1822460, activity:1822471, activity:1822478, activity:1822495, activity:1822887, activity:1822933, activity:1822979