184360

Source:http://linkedlifedata.com/resource/chembl/compound/184360

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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/C18H14O4/c1-2-9-21-14-7-8-15-17(10-14)22-11-16(18(15)20)12-3-5-13(19)6-4-12/h2-8,10-11,19H,1,9H2
chemicalCompound:standardIn...	CQXFYCAQUMOIAK-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Oc1ccc(cc1)C2=COc3cc(OCC=C)ccc3C2=O
chemicalCompound:molecularF...	C18 H14 O4
chemicalCompound:moleculeId	184360
chemicalCompound:mwFreebase	294.301
chemicalCompound:alogp	3.225
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	55.76
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.64
chemicalCompound:acdLogP	3.709
chemicalCompound:acdLogD	3.706
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	294.301
chemicalCompound:chemblId	CHEMBL112165
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:284360
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:636762, activity:636763, activity:636764, activity:636765, activity:636766, activity:636767, activity:636768, activity:636769, activity:636770, activity:636771, activity:636772, activity:636773, activity:636774, activity:760513, activity:760514