1292218

Source:http://linkedlifedata.com/resource/chembl/compound/1292218

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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/C13H11ClN4O4/c14-9-3-1-8(2-4-9)7-10-15-16-13(22)18(10)17-11(19)5-6-12(20)21/h1-6H,7H2,(H,16,22)(H,17,19)(H,20,21)/b6-5-
chemicalCompound:standardIn...	AKAQPUPIWXZUEM-WAYWQWQTSA-N
chemicalCompound:canonicalS...	OC(=O)\C=C/C(=O)NN1C(=O)NN=C1Cc2ccc(Cl)cc2
chemicalCompound:molecularF...	C13H11ClN4O4
chemicalCompound:moleculeId	1292218
chemicalCompound:mwFreebase	322.704
chemicalCompound:alogp	1.191
chemicalCompound:hba	5
chemicalCompound:hbd	3
chemicalCompound:psa	111.1
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	3.448
chemicalCompound:acdLogP	0
chemicalCompound:acdLogD	-3.843
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	322.704
chemicalCompound:chemblId	CHEMBL1970927
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1392218
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:8245949, activity:8284048, activity:8310362, activity:8493720, activity:8572346, activity:8578832, activity:8587950, activity:8643530, activity:8660316, activity:8723872, activity:8764095, activity:8771176, activity:8796206, activity:8807479, activity:8899296, activity:8928765, activity:8967186, activity:9017158, activity:9093274, activity:9139687, activity:9290005, activity:9356568, activity:9426198, activity:9504992, activity:9538681, activity:9679584, activity:9716643, activity:9759067, activity:9863376, activity:9892386, activity:9926274, activity:9959638, activity:9981145, activity:9996608, activity:10076951, activity:10164086, activity:10166521, activity:10195668, activity:10250444, activity:10298694, activity:10369060, activity:10396780, activity:10415620, activity:10442801, activity:10494416, activity:10591475, activity:10609225, activity:10672020, activity:10778135, activity:10793618