871603

Source:http://linkedlifedata.com/resource/chembl/compound/871603

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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/C19H20N4/c1-14-6-4-5-13-23(14)19-16-7-2-3-8-17(16)21-18(22-19)15-9-11-20-12-10-15/h2-3,7-12,14H,4-6,13H2,1H3
chemicalCompound:standardIn...	OXWFTMXZJCILRG-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC1CCCCN1c2nc(nc3ccccc23)c4ccncc4
chemicalCompound:molecularF...	C19H20N4
chemicalCompound:moleculeId	871603
chemicalCompound:mwFreebase	304.389
chemicalCompound:alogp	3.233
chemicalCompound:hba	4
chemicalCompound:hbd	0
chemicalCompound:psa	41.91
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.421
chemicalCompound:acdLogD	4.415
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	304.389
chemicalCompound:acdMostBpk...	5.471
chemicalCompound:chemblId	CHEMBL1447719
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:971603
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:3631336, activity:3922630, activity:4009287, activity:4108941, activity:4130892, activity:4388290, activity:4412244, activity:4443958, activity:4465959, activity:4520909, activity:4524486, activity:4618055, activity:4727438, activity:4817363, activity:5411166, activity:5864191, activity:5987217, activity:6059638, activity:6060611, activity:6061501, activity:6071296, activity:7033814, activity:7172850, activity:7236466, activity:7512211, activity:10634305