1021757

Source:http://linkedlifedata.com/resource/chembl/compound/1021757

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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/C22H30O5/c1-5-6-7-8-9-18-12-16-13-21(25-3)22(26-4)15-19(16)20(27-18)14-17(23)10-11-24-2/h10-13,15,20H,5-9,14H2,1-4H3/b11-10+
chemicalCompound:standardIn...	VRFMBSXPRBPZNN-ZHACJKMWSA-N
chemicalCompound:canonicalS...	CCCCCCC1=Cc2cc(OC)c(OC)cc2C(CC(=O)\C=C\OC)O1
chemicalCompound:molecularF...	C22H30O5
chemicalCompound:moleculeId	1021757
chemicalCompound:mwFreebase	374.471
chemicalCompound:alogp	4.269
chemicalCompound:hba	5
chemicalCompound:hbd	0
chemicalCompound:psa	53.99
chemicalCompound:rtb	11
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	3.338
chemicalCompound:acdLogD	3.338
chemicalCompound:fullMwt	374.471
chemicalCompound:chemblId	CHEMBL1597873
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1121757
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:4859987, activity:4949259, activity:5078608