476220

Source:http://linkedlifedata.com/resource/chembl/compound/476220

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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/C28H51NO7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(30)29-28(21-18-25(31)32,22-19-26(33)34)23-20-27(35)36/h2-23H2,1H3,(H,29,30)(H,31,32)(H,33,34)(H,35,36)
chemicalCompound:standardIn...	WKEOHNBSQZOTRP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCCCCCCCCCCCCCCC(=O)NC(CCC(=O)O)(CCC(=O)O)CCC(=O)O
chemicalCompound:molecularF...	C28H51NO7
chemicalCompound:moleculeId	476220
chemicalCompound:mwFreebase	513.707
chemicalCompound:alogp	6.921
chemicalCompound:hba	7
chemicalCompound:hbd	4
chemicalCompound:psa	141
chemicalCompound:rtb	26
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	2
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	4.028
chemicalCompound:acdLogP	6.41
chemicalCompound:acdLogD	0.676
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	513.707
chemicalCompound:chemblId	CHEMBL473640
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:576220
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:2417783, activity:2417799, activity:2417815, activity:2417831, activity:2417847, activity:2417862, activity:2417879, activity:2417894, activity:2417898, activity:2417901