239937

Source:http://linkedlifedata.com/resource/chembl/compound/239937

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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/C15H20O3/c1-3-4-5-8-15(2)10-13(17)12-7-6-11(16)9-14(12)18-15/h6-7,9,16H,3-5,8,10H2,1-2H3
chemicalCompound:standardIn...	QRFAYYPIRFDIBC-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCCC1(C)CC(=O)c2ccc(O)cc2O1
chemicalCompound:molecularF...	C15 H20 O3
chemicalCompound:moleculeId	239937
chemicalCompound:mwFreebase	248.318
chemicalCompound:alogp	3.72
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	46.53
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	7.763
chemicalCompound:acdLogP	4.348
chemicalCompound:acdLogD	4.192
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	248.318
chemicalCompound:chemblId	CHEMBL141778
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:339937
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:1283938, activity:1283939, activity:1283940, activity:1283941, activity:1283942, activity:1283943, activity:1283944, activity:1283945