1163326

Source:http://linkedlifedata.com/resource/chembl/compound/1163326

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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/C13H10N2O4/c16-12-4-2-1-3-11(12)13(17)14-9-5-7-10(8-6-9)15(18)19/h1-8,16H,(H,14,17)
chemicalCompound:standardIn...	UGZDFLLCOFLFNY-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Oc1ccccc1C(=O)Nc2ccc(cc2)[N+](=O)[O-]
chemicalCompound:molecularF...	C13H10N2O4
chemicalCompound:moleculeId	1163326
chemicalCompound:mwFreebase	258.229
chemicalCompound:alogp	2.267
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	95.15
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	8.14
chemicalCompound:acdLogP	3.377
chemicalCompound:acdLogD	3.271
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	258.229
chemicalCompound:chemblId	CHEMBL1802243
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1263326
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:6273190, activity:6273204, activity:6273216