152954

Source:http://linkedlifedata.com/resource/chembl/compound/152954

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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/C18H18O8/c19-12-2-1-11(16(22)17(12)23)18(24)25-4-3-9-5-10-6-13(20)14(21)7-15(10)26-8-9/h1-2,6-7,9,19-23H,3-5,8H2
chemicalCompound:standardIn...	ZLAOMLWJCCKPLL-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Oc1cc2CC(CCOC(=O)c3ccc(O)c(O)c3O)COc2cc1O
chemicalCompound:molecularF...	C18 H18 O8
chemicalCompound:moleculeId	152954
chemicalCompound:mwFreebase	362.331
chemicalCompound:alogp	2.727
chemicalCompound:hba	8
chemicalCompound:hbd	5
chemicalCompound:psa	136.68
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	7.558
chemicalCompound:acdLogP	2.78
chemicalCompound:acdLogD	2.454
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	362.331
chemicalCompound:chemblId	CHEMBL92138
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:252954
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:362565, activity:362566