11846

Source:http://linkedlifedata.com/resource/chembl/compound/11846

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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/C24H33NO2/c1-4-7-8-9-24(20-10-14-22(26)15-11-20)21-12-16-23(17-13-21)27-19-18-25(5-2)6-3/h9-17,26H,4-8,18-19H2,1-3H3/b24-9+
chemicalCompound:standardIn...	RIMXSFHITCMBCL-PGGKNCGUSA-N
chemicalCompound:canonicalS...	CCCC\C=C(/c1ccc(O)cc1)\c2ccc(OCCN(CC)CC)cc2
chemicalCompound:molecularF...	C24 H33 N O2
chemicalCompound:moleculeId	11846
chemicalCompound:mwFreebase	367.524
chemicalCompound:alogp	6.209
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	32.7
chemicalCompound:rtb	11
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	10.243
chemicalCompound:acdLogP	6.116
chemicalCompound:acdLogD	3.933
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	367.524
chemicalCompound:acdMostBpk...	9.639
chemicalCompound:chemblId	CHEMBL12865
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:111846
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:651867, activity:651868, activity:651869, activity:651870, activity:651871, activity:651872