11617

Source:http://linkedlifedata.com/resource/chembl/compound/11617

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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/C27H37NO2/c1-20(2)28(21(3)4)18-19-30-26-16-12-24(13-17-26)27(22-8-6-5-7-9-22)23-10-14-25(29)15-11-23/h10-17,20-21,29H,5-9,18-19H2,1-4H3
chemicalCompound:standardIn...	FDRISEUHVWYNDI-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)N(CCOc1ccc(cc1)C(=C2CCCCC2)c3ccc(O)cc3)C(C)C
chemicalCompound:molecularF...	C27 H37 N O2
chemicalCompound:moleculeId	11617
chemicalCompound:mwFreebase	407.588
chemicalCompound:alogp	7.038
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	32.7
chemicalCompound:rtb	8
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	10.134
chemicalCompound:acdLogP	6.719
chemicalCompound:acdLogD	4.356
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	407.588
chemicalCompound:acdMostBpk...	9.849
chemicalCompound:chemblId	CHEMBL273663
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:111617
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:667874, activity:667875, activity:667876, activity:667877, activity:667878, activity:667879