924940

Source:http://linkedlifedata.com/resource/chembl/compound/924940

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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/C19H17N5O2/c1-11(2)24-18(26)13-8-4-3-7-12(13)16(23-24)17(25)22-19-20-14-9-5-6-10-15(14)21-19/h3-11H,1-2H3,(H2,20,21,22,25)
chemicalCompound:standardIn...	UWLXKSJTZYFYFB-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)N1N=C(C(=O)Nc2nc3ccccc3[nH]2)c4ccccc4C1=O
chemicalCompound:molecularF...	C19H17N5O2
chemicalCompound:moleculeId	924940
chemicalCompound:mwFreebase	347.371
chemicalCompound:alogp	2.753
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	90.44
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	8.462
chemicalCompound:acdLogP	3.286
chemicalCompound:acdLogD	3.274
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	347.371
chemicalCompound:acdMostBpk...	4.594
chemicalCompound:chemblId	CHEMBL1501056
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1024940
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:3644856, activity:4094156, activity:4135503, activity:4535505, activity:4597405, activity:4758538, activity:4779678, activity:5365559, activity:5436459, activity:5585496, activity:5814483, activity:5896036, activity:6520917, activity:7321677, activity:7386691, activity:7433287