297565

Source:http://linkedlifedata.com/resource/chembl/compound/297565

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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/c13-9-3-1-8(2-4-9)5-18-7-17-12-10(18)11(14)15-6-16-12/h1-4,6-7H,5H2,(H2,14,15,16)
chemicalCompound:standardIn...	CQLKWESHTUNFIE-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Nc1ncnc2ncn(Cc3ccc(F)cc3)c12
chemicalCompound:molecularF...	C12 H10 F N5
chemicalCompound:moleculeId	297565
chemicalCompound:mwFreebase	243.24
chemicalCompound:alogp	1.549
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	69.62
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.75
chemicalCompound:acdLogD	1.75
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	243.24
chemicalCompound:acdMostBpk...	4.56
chemicalCompound:chemblId	CHEMBL180422
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:397565
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:1407954, activity:1407955, activity:1407956, activity:1407957, activity:1407958, activity:1407959, activity:1407960, activity:1407961, activity:1407962, activity:1407963, activity:1407964, activity:1407965, activity:1407966, activity:1407967, activity:1407968