391654

Source:http://linkedlifedata.com/resource/chembl/compound/391654

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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/C14H13FN2O2/c15-10-6-4-9(5-7-10)8-13(19)17-14-11(16)2-1-3-12(14)18/h1-7,18H,8,16H2,(H,17,19)
chemicalCompound:standardIn...	UFHKJIXCPANSIN-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Nc1cccc(O)c1NC(=O)Cc2ccc(F)cc2
chemicalCompound:molecularF...	C14 H13 F N2 O2
chemicalCompound:moleculeId	391654
chemicalCompound:mwFreebase	260.264
chemicalCompound:alogp	1.866
chemicalCompound:hba	3
chemicalCompound:hbd	3
chemicalCompound:psa	75.34
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.4
chemicalCompound:acdLogP	1.2
chemicalCompound:acdLogD	1.194
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	260.264
chemicalCompound:acdMostBpk...	4.571
chemicalCompound:chemblId	CHEMBL243194
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:491654
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:1942730, activity:1942761, activity:1942813, activity:1942844, activity:1942875, activity:1942906, activity:1942937, activity:1942968, activity:1942999, activity:1943030, activity:1943059, activity:1943088