568924

Source:http://linkedlifedata.com/resource/chembl/compound/568924

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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/C17H20F2N4/c1-23(2)12-4-11-20-13-7-9-14(10-8-13)21-22-17-15(18)5-3-6-16(17)19/h3,5-10,20H,4,11-12H2,1-2H3/b22-21+
chemicalCompound:standardIn...	AOWSXBMELKBWEQ-QURGRASLSA-N
chemicalCompound:canonicalS...	CN(C)CCCNc1ccc(cc1)N=Nc2c(F)cccc2F
chemicalCompound:molecularF...	C17H20F2N4
chemicalCompound:moleculeId	568924
chemicalCompound:mwFreebase	318.364
chemicalCompound:alogp	4.62
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	39.99
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.925
chemicalCompound:acdLogD	0.859
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	318.364
chemicalCompound:acdMostBpk...	9.501
chemicalCompound:chemblId	CHEMBL573609
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:668924
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:2913544, activity:2913602, activity:2913660, activity:2913718, activity:2913776, activity:2914206, activity:2914264, activity:2914297, activity:2914355, activity:2914413, activity:2914427, activity:2914439, activity:2914451, activity:2914458