11655

Source:http://linkedlifedata.com/resource/chembl/compound/11655

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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/C23H31NO2/c1-5-24(6-2)15-16-26-22-13-9-20(10-14-22)23(17-18(3)4)19-7-11-21(25)12-8-19/h7-14,17-18,25H,5-6,15-16H2,1-4H3/b23-17-
chemicalCompound:standardIn...	OLEOZDOZISINBP-QJOMJCCJSA-N
chemicalCompound:canonicalS...	CCN(CC)CCOc1ccc(cc1)\C(=C/C(C)C)\c2ccc(O)cc2
chemicalCompound:molecularF...	C23 H31 N O2
chemicalCompound:moleculeId	11655
chemicalCompound:mwFreebase	353.498
chemicalCompound:alogp	5.548
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	32.7
chemicalCompound:rtb	9
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	10.319
chemicalCompound:acdLogP	5.451
chemicalCompound:acdLogD	3.269
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	353.498
chemicalCompound:acdMostBpk...	9.638
chemicalCompound:chemblId	CHEMBL13289
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:111655
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:648231, activity:648232, activity:648233, activity:648234, activity:648235, activity:648236