297710

Source:http://linkedlifedata.com/resource/chembl/compound/297710

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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/C12H10FN5/c1-18-7-16-10-11(14-6-15-12(10)18)17-9-4-2-8(13)3-5-9/h2-7H,1H3,(H,14,15,17)
chemicalCompound:standardIn...	JDDWQQHPEXJAKO-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cn1cnc2c(Nc3ccc(F)cc3)ncnc12
chemicalCompound:molecularF...	C12 H10 F N5
chemicalCompound:moleculeId	297710
chemicalCompound:mwFreebase	243.24
chemicalCompound:alogp	2.266
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	55.63
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.993
chemicalCompound:acdLogD	1.993
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	243.24
chemicalCompound:acdMostBpk...	2.779
chemicalCompound:chemblId	CHEMBL362629
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:397710
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:1406765, activity:1406766, activity:1406767, activity:1406768, activity:1406769, activity:1406770, activity:1406771, activity:1406772, activity:1406773, activity:1406774, activity:1406775, activity:1406776, activity:1406777, activity:1406778, activity:1406779