476496

Source:http://linkedlifedata.com/resource/chembl/compound/476496

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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/C27H49NO8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-36-26(35)28-27(19-16-23(29)30,20-17-24(31)32)21-18-25(33)34/h2-22H2,1H3,(H,28,35)(H,29,30)(H,31,32)(H,33,34)
chemicalCompound:standardIn...	CJFXTEXKNIORLP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCCCCCCCCCCCCCOC(=O)NC(CCC(=O)O)(CCC(=O)O)CCC(=O)O
chemicalCompound:molecularF...	C27H49NO8
chemicalCompound:moleculeId	476496
chemicalCompound:mwFreebase	515.68
chemicalCompound:alogp	6.857
chemicalCompound:hba	8
chemicalCompound:hbd	4
chemicalCompound:psa	150.23
chemicalCompound:rtb	26
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	2
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	4.07
chemicalCompound:acdLogP	6.612
chemicalCompound:acdLogD	0.879
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	515.68
chemicalCompound:chemblId	CHEMBL475841
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:576496
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:2417779, activity:2417795, activity:2417811, activity:2417827, activity:2417843, activity:2417858, activity:2417875, activity:2417890, activity:2417916