264136

Source:http://linkedlifedata.com/resource/chembl/compound/264136

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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/C17H29NO4S/c1-12(11-23-15(21)9-17(2,3)4)16(22)18(10-14(19)20)13-7-5-6-8-13/h12-13H,5-11H2,1-4H3,(H,19,20)
chemicalCompound:standardIn...	NLBPJLBGGISTIW-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(CSC(=O)CC(C)(C)C)C(=O)N(CC(=O)O)C1CCCC1
chemicalCompound:molecularF...	C17 H29 N O4 S
chemicalCompound:moleculeId	264136
chemicalCompound:mwFreebase	343.481
chemicalCompound:alogp	3.02
chemicalCompound:hba	5
chemicalCompound:hbd	1
chemicalCompound:psa	99.98
chemicalCompound:rtb	9
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	3.483
chemicalCompound:acdLogP	3.258
chemicalCompound:acdLogD	-0.389
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	343.481
chemicalCompound:chemblId	CHEMBL160942
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:364136
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:710522, activity:710523