911914

Source:http://linkedlifedata.com/resource/chembl/compound/911914

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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/C19H22N2O3/c1-23-14-8-10-15-12(11-14)7-9-16-17(21-24-18(15)16)19(22)20-13-5-3-2-4-6-13/h8,10-11,13H,2-7,9H2,1H3,(H,20,22)
chemicalCompound:standardIn...	RGMBHEHSMSYQBO-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COc1ccc2c(CCc3c2onc3C(=O)NC4CCCCC4)c1
chemicalCompound:molecularF...	C19H22N2O3
chemicalCompound:moleculeId	911914
chemicalCompound:mwFreebase	326.39
chemicalCompound:alogp	4.173
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	64.36
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	11.525
chemicalCompound:acdLogP	4.422
chemicalCompound:acdLogD	4.422
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	326.39
chemicalCompound:chemblId	CHEMBL1488030
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1011914
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:3622294, activity:3820536, activity:3832987, activity:3872180, activity:3925744, activity:4070726, activity:4131364, activity:4415861, activity:4521332, activity:4558721, activity:4620257, activity:4738477, activity:4748172, activity:4805741, activity:4839359, activity:4916663, activity:5007153, activity:5546489, activity:5677761, activity:5891687, activity:6552769, activity:6789758, activity:7188675, activity:7414695