431876

Source:http://linkedlifedata.com/resource/chembl/compound/431876

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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/C28H23NO4/c1-3-25(30)32-24-14-13-19-17(2)15-26(31)33-28(19)22(24)16-21-20-11-7-8-12-23(20)29-27(21)18-9-5-4-6-10-18/h4-15,29H,3,16H2,1-2H3
chemicalCompound:standardIn...	DWMDEHIOZHGOHZ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCC(=O)Oc1ccc2C(=CC(=O)Oc2c1Cc3c([nH]c4ccccc34)c5ccccc5)C
chemicalCompound:molecularF...	C28 H23 N O4
chemicalCompound:moleculeId	431876
chemicalCompound:mwFreebase	437.487
chemicalCompound:alogp	6.858
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	68.39
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	5.274
chemicalCompound:acdLogD	5.274
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	437.487
chemicalCompound:chemblId	CHEMBL265201
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:531876
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:2135187, activity:2135250, activity:2135311, activity:2135346, activity:2135416, activity:2135480, activity:2135544, activity:2135608, activity:2135672