1222343

Source:http://linkedlifedata.com/resource/chembl/compound/1222343

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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/C14H14N6O4/c1-18-12-11(13(22)19(2)14(18)23)20(8-15-12)7-10(21)17-16-6-9-4-3-5-24-9/h3-6,8H,7H2,1-2H3,(H,17,21)
chemicalCompound:standardIn...	SYJUZHPKAHCNHW-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CN1C(=O)N(C)c2ncn(CC(=O)NN=Cc3occc3)c2C1=O
chemicalCompound:molecularF...	C14H14N6O4
chemicalCompound:moleculeId	1222343
chemicalCompound:mwFreebase	330.299
chemicalCompound:alogp	0
chemicalCompound:hba	5
chemicalCompound:hbd	1
chemicalCompound:psa	113.04
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	12.319
chemicalCompound:acdLogP	0.752
chemicalCompound:acdLogD	0.752
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	330.299
chemicalCompound:chemblId	CHEMBL1881772
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1322343
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:6710580