286914

Source:http://linkedlifedata.com/resource/chembl/compound/286914

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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/C14H17FN2/c1-9-2-3-10-6-12(15)7-13-11(4-5-16)8-17(9)14(10)13/h6-9H,2-5,16H2,1H3
chemicalCompound:standardIn...	IMICWWRDHASRGJ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC1CCc2cc(F)cc3c(CCN)cn1c23
chemicalCompound:molecularF...	C14 H17 F N2
chemicalCompound:moleculeId	286914
chemicalCompound:mwFreebase	232.297
chemicalCompound:alogp	2.87
chemicalCompound:hba	1
chemicalCompound:hbd	1
chemicalCompound:psa	30.95
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.183
chemicalCompound:acdLogD	-0.248
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	232.297
chemicalCompound:acdMostBpk...	9.935
chemicalCompound:chemblId	CHEMBL355474
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:386914
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:77791, activity:77792, activity:77793, activity:77794, activity:77795