569887

Source:http://linkedlifedata.com/resource/chembl/compound/569887

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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/C24H27F3N4O3/c1-23(2,3)21-22(34)31(10-9-28-20(33)14-32)19-12-17(7-8-18(19)30-21)29-13-15-5-4-6-16(11-15)24(25,26)27/h4-8,11-12,29,32H,9-10,13-14H2,1-3H3,(H,28,33)
chemicalCompound:standardIn...	GXXXSSMSOIBPLY-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)(C)C1=Nc2ccc(NCc3cccc(c3)C(F)(F)F)cc2N(CCNC(=O)CO)C1=O
chemicalCompound:molecularF...	C24H27F3N4O3
chemicalCompound:moleculeId	569887
chemicalCompound:mwFreebase	476.491
chemicalCompound:alogp	3.44
chemicalCompound:hba	5
chemicalCompound:hbd	3
chemicalCompound:psa	94.03
chemicalCompound:rtb	9
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	13.29
chemicalCompound:acdLogP	3.081
chemicalCompound:acdLogD	3.081
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	476.491
chemicalCompound:acdMostBpk...	2.348
chemicalCompound:chemblId	CHEMBL574943
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:669887
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:2913955