575177

Source:http://linkedlifedata.com/resource/chembl/compound/575177

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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/C23H20O10/c1-28-16-6-10-14(8-18(16)30-3)32-22(26)12(20(10)24)5-13-21(25)11-7-17(29-2)19(31-4)9-15(11)33-23(13)27/h6-9,24-25H,5H2,1-4H3
chemicalCompound:standardIn...	QBPJMTXRFMJGAJ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COc1cc2OC(=O)C(=C(O)c2cc1OC)CC3=C(O)c4cc(OC)c(OC)cc4OC3=O
chemicalCompound:molecularF...	C23H20O10
chemicalCompound:moleculeId	575177
chemicalCompound:mwFreebase	456.399
chemicalCompound:alogp	2.723
chemicalCompound:hba	10
chemicalCompound:hbd	2
chemicalCompound:psa	129.98
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	4.199
chemicalCompound:acdLogP	1.216
chemicalCompound:acdLogD	-1.842
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	456.399
chemicalCompound:chemblId	CHEMBL570332
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:675177
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:2939804, activity:2939833, activity:2939857, activity:2939872, activity:2939887, activity:2940542