882347

Source:http://linkedlifedata.com/resource/chembl/compound/882347

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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/C19H21N3O2/c1-11-17(13(3)23)12(2)22-18(11)19(24)20-9-8-14-10-21-16-7-5-4-6-15(14)16/h4-7,10,21-22H,8-9H2,1-3H3,(H,20,24)
chemicalCompound:standardIn...	VUWJIMWJHAMLQA-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(=O)c1c(C)[nH]c(C(=O)NCCc2c[nH]c3ccccc23)c1C
chemicalCompound:molecularF...	C19H21N3O2
chemicalCompound:moleculeId	882347
chemicalCompound:mwFreebase	323.389
chemicalCompound:alogp	2.993
chemicalCompound:hba	2
chemicalCompound:hbd	3
chemicalCompound:psa	77.75
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	0.752
chemicalCompound:acdLogD	0.752
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	323.389
chemicalCompound:chemblId	CHEMBL1458463
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:982347
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:3832986, activity:4748170, activity:5442295, activity:5677757, activity:5891664, activity:6552752, activity:6653858