202619

Source:http://linkedlifedata.com/resource/chembl/compound/202619

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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/C27H45NO3/c1-3-4-5-6-8-11-14-23-20-24(23)15-12-9-7-10-13-16-27(30)28-21-22-17-18-25(29)26(19-22)31-2/h17-19,23-24,29H,3-16,20-21H2,1-2H3,(H,28,30)/t23-,24+/m1/s1
chemicalCompound:standardIn...	WGKRHPJCQPXIJK-RPWUZVMVSA-N
chemicalCompound:canonicalS...	CCCCCCCC[C@@H]1C[C@@H]1CCCCCCCC(=O)NCc2ccc(O)c(OC)c2
chemicalCompound:molecularF...	C27 H45 N O3
chemicalCompound:moleculeId	202619
chemicalCompound:mwFreebase	431.651
chemicalCompound:alogp	7.884
chemicalCompound:hba	3
chemicalCompound:hbd	2
chemicalCompound:psa	58.56
chemicalCompound:rtb	18
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	9.765
chemicalCompound:acdLogP	7.695
chemicalCompound:acdLogD	7.693
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	431.651
chemicalCompound:chemblId	CHEMBL124002
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:302619
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:1201610, activity:1201611