465909

Source:http://linkedlifedata.com/resource/chembl/compound/465909

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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/C15H22O4/c1-2-3-4-5-6-7-8-12(16)11-9-13(17)15(19)14(18)10-11/h9-10,17-19H,2-8H2,1H3
chemicalCompound:standardIn...	NVFRHTFJDGAFQS-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCCCCCC(=O)c1cc(O)c(O)c(O)c1
chemicalCompound:molecularF...	C15H22O4
chemicalCompound:moleculeId	465909
chemicalCompound:mwFreebase	266.333
chemicalCompound:alogp	4.248
chemicalCompound:hba	4
chemicalCompound:hbd	3
chemicalCompound:psa	77.76
chemicalCompound:rtb	8
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	7.868
chemicalCompound:acdLogP	4.192
chemicalCompound:acdLogD	4.038
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	266.333
chemicalCompound:chemblId	CHEMBL464853
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:565909
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:2191226, activity:2191234, activity:2191244, activity:2191252, activity:2191261, activity:2191264, activity:2191273, activity:2191278, activity:2191290, activity:2191298, activity:2191309, activity:2191314, activity:2191319, activity:2191324