297566

Source:http://linkedlifedata.com/resource/chembl/compound/297566

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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/C13H11FN4O/c1-19-13-11-12(15-7-16-13)17-8-18(11)6-9-2-4-10(14)5-3-9/h2-5,7-8H,6H2,1H3
chemicalCompound:standardIn...	SQDZUTFNGVKMTJ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COc1ncnc2ncn(Cc3ccc(F)cc3)c12
chemicalCompound:molecularF...	C13 H11 F N4 O
chemicalCompound:moleculeId	297566
chemicalCompound:mwFreebase	258.251
chemicalCompound:alogp	2.28
chemicalCompound:hba	4
chemicalCompound:hbd	0
chemicalCompound:psa	52.83
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.541
chemicalCompound:acdLogD	2.541
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	258.251
chemicalCompound:acdMostBpk...	1.901
chemicalCompound:chemblId	CHEMBL368714
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:397566
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:1407969, activity:1407970, activity:1407971, activity:1407972, activity:1407973, activity:1407974, activity:1407975, activity:1407976, activity:1407977, activity:1407978, activity:1407979, activity:1407980, activity:1408081, activity:1408082, activity:1408083