370657

Source:http://linkedlifedata.com/resource/chembl/compound/370657

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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/C9H4N4O4/c10-3-4-1-5-6(2-7(4)13(16)17)12-9(15)8(14)11-5/h1-2H,(H,11,14)(H,12,15)
chemicalCompound:standardIn...	RPXVIAFEQBNEAX-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Oc1nc2cc(C#N)c(cc2nc1O)[N+](=O)[O-]
chemicalCompound:molecularF...	C9 H4 N4 O4
chemicalCompound:moleculeId	370657
chemicalCompound:mwFreebase	232.152
chemicalCompound:alogp	1.661
chemicalCompound:hba	7
chemicalCompound:hbd	2
chemicalCompound:psa	135.85
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	4.84
chemicalCompound:acdLogP	1.316
chemicalCompound:acdLogD	-1.364
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	232.152
chemicalCompound:chemblId	CHEMBL222418
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:470657
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:4009500, activity:4443978, activity:4647756, activity:4852598, activity:5339936, activity:5344565, activity:5998640, activity:6005866, activity:6009095, activity:6016132, activity:6046211, activity:7014661, activity:7562711