121574

Source:http://linkedlifedata.com/resource/chembl/compound/121574

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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/C24H27NO4S/c1-17(2)18-11-13-21-19(16-23(24(26)27)22(21)14-12-18)8-6-7-15-25-30(28,29)20-9-4-3-5-10-20/h3-5,9-14,16-17,25H,6-8,15H2,1-2H3,(H,26,27)
chemicalCompound:standardIn...	NABDGKYIEDLLPV-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)c1ccc2c(CCCCNS(=O)(=O)c3ccccc3)cc(C(=O)O)c2cc1
chemicalCompound:molecularF...	C24 H27 N O4 S
chemicalCompound:moleculeId	121574
chemicalCompound:mwFreebase	425.54
chemicalCompound:alogp	5.29
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	91.85
chemicalCompound:rtb	9
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	5.444
chemicalCompound:fullMwt	425.54
chemicalCompound:chemblId	CHEMBL75309
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:221574
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:454805, activity:454806, activity:454807, activity:663320, activity:663321, activity:663322, activity:663323