11989

Source:http://linkedlifedata.com/resource/chembl/compound/11989

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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/C26H37NO2/c1-4-7-8-9-10-11-26(22-12-16-24(28)17-13-22)23-14-18-25(19-15-23)29-21-20-27(5-2)6-3/h11-19,28H,4-10,20-21H2,1-3H3/b26-11-
chemicalCompound:standardIn...	NLUMLXMYTSTSKI-RAWMCFOBSA-N
chemicalCompound:canonicalS...	CCCCCC\C=C(\c1ccc(O)cc1)/c2ccc(OCCN(CC)CC)cc2
chemicalCompound:molecularF...	C26 H37 N O2
chemicalCompound:moleculeId	11989
chemicalCompound:mwFreebase	395.577
chemicalCompound:alogp	7.121
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	32.7
chemicalCompound:rtb	13
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	10.265
chemicalCompound:acdLogP	7.135
chemicalCompound:acdLogD	4.952
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	395.577
chemicalCompound:acdMostBpk...	9.64
chemicalCompound:chemblId	CHEMBL13510
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:111989
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:655326, activity:655327, activity:655328, activity:655329, activity:655330, activity:655331