353896

Source:http://linkedlifedata.com/resource/chembl/compound/353896

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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/C19H15FN2O3/c1-25-18-13-3-2-8-21-16(13)17(23)15-14(18)10-22(19(15)24)9-11-4-6-12(20)7-5-11/h2-8,23H,9-10H2,1H3
chemicalCompound:standardIn...	QRXAOOQIACOJRH-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COc1c2CN(Cc3ccc(F)cc3)C(=O)c2c(O)c4ncccc14
chemicalCompound:molecularF...	C19H15FN2O3
chemicalCompound:moleculeId	353896
chemicalCompound:mwFreebase	338.332
chemicalCompound:alogp	2.714
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	62.66
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.07
chemicalCompound:acdLogD	1.785
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	338.332
chemicalCompound:acdMostBpk...	9.593
chemicalCompound:chemblId	CHEMBL209440
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:453896
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:1758762, activity:1758764, activity:1758765, activity:1758856, activity:1758871, activity:1758942, activity:1758943, activity:1758944, activity:1759053, activity:1759054, activity:1759055, activity:1759056, activity:2920560