481076

Source:http://linkedlifedata.com/resource/chembl/compound/481076

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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/C20H22O8/c1-23-11-7-6-10(8-12(11)24-2)18-17(22)16(21)15-13(28-18)9-14(25-3)19(26-4)20(15)27-5/h6-9,17-18,22H,1-5H3/t17-,18-/m0/s1
chemicalCompound:standardIn...	ZSTDIJUTEZNPGU-ROUUACIJSA-N
chemicalCompound:canonicalS...	COc1ccc(cc1OC)[C@@H]2Oc3cc(OC)c(OC)c(OC)c3C(=O)[C@@H]2O
chemicalCompound:molecularF...	C20H22O8
chemicalCompound:moleculeId	481076
chemicalCompound:mwFreebase	390.384
chemicalCompound:alogp	2.365
chemicalCompound:hba	8
chemicalCompound:hbd	1
chemicalCompound:psa	92.68
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	11.642
chemicalCompound:acdLogP	1.711
chemicalCompound:acdLogD	1.711
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	390.384
chemicalCompound:chemblId	CHEMBL482234
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:581076
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:2636936, activity:2636946, activity:2636951, activity:2636956, activity:2636961