310314

Source:http://linkedlifedata.com/resource/chembl/compound/310314

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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/C19H19F6N3O2/c20-18(21,22)14-6-8-15(9-7-14)28-17(29)27-11-3-10-26-12-13-4-1-2-5-16(13)30-19(23,24)25/h1-2,4-9,26H,3,10-12H2,(H2,27,28,29)
chemicalCompound:standardIn...	APSLXGCJDDWMBA-UHFFFAOYSA-N
chemicalCompound:canonicalS...	FC(F)(F)Oc1ccccc1CNCCCNC(=O)Nc2ccc(cc2)C(F)(F)F
chemicalCompound:molecularF...	C19 H19 F6 N3 O2
chemicalCompound:moleculeId	310314
chemicalCompound:mwFreebase	435.363
chemicalCompound:alogp	5.257
chemicalCompound:hba	3
chemicalCompound:hbd	3
chemicalCompound:psa	62.39
chemicalCompound:rtb	10
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	13.599
chemicalCompound:acdLogP	3.767
chemicalCompound:acdLogD	2.382
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	435.363
chemicalCompound:acdMostBpk...	8.817
chemicalCompound:chemblId	CHEMBL184395
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:410314
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:1455768