1008369

Source:http://linkedlifedata.com/resource/chembl/compound/1008369

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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/C21H20N4O4/c26-20(15-10-12-16(13-11-15)25(28)29)23-24-19(14-6-2-1-3-7-14)22-18-9-5-4-8-17(18)21(24)27/h4-5,8-14H,1-3,6-7H2,(H,23,26)
chemicalCompound:standardIn...	UOCUOBMNVNTILH-UHFFFAOYSA-N
chemicalCompound:canonicalS...	[O-][N+](=O)c1ccc(cc1)C(=O)NN2C(=O)c3ccccc3N=C2C4CCCCC4
chemicalCompound:molecularF...	C21H20N4O4
chemicalCompound:moleculeId	1008369
chemicalCompound:mwFreebase	392.408
chemicalCompound:alogp	3.889
chemicalCompound:hba	5
chemicalCompound:hbd	1
chemicalCompound:psa	107.59
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	8.453
chemicalCompound:acdLogP	4.431
chemicalCompound:acdLogD	4.384
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	392.408
chemicalCompound:chemblId	CHEMBL1584485
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1108369
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:3750493, activity:4345799, activity:5408683, activity:5485193, activity:5643057, activity:6489174, activity:7259315, activity:7389777, activity:7507383, activity:10608356