106509

Source:http://linkedlifedata.com/resource/chembl/compound/106509

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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/C25H30N2O4S2/c1-21-9-11-24(12-10-21)20-26(19-23-7-5-4-6-8-23)18-17-22-13-15-25(16-14-22)27(32(2,28)29)33(3,30)31/h4-16H,17-20H2,1-3H3
chemicalCompound:standardIn...	GFBCYHKIJYOJCV-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1ccc(CN(CCc2ccc(cc2)N(S(=O)(=O)C)S(=O)(=O)C)Cc3ccccc3)cc1
chemicalCompound:molecularF...	C25 H30 N2 O4 S2
chemicalCompound:moleculeId	106509
chemicalCompound:mwFreebase	486.647
chemicalCompound:alogp	4.569
chemicalCompound:hba	5
chemicalCompound:hbd	0
chemicalCompound:psa	91.52
chemicalCompound:rtb	10
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.475
chemicalCompound:acdLogD	4.147
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	486.647
chemicalCompound:acdMostBpk...	7.453
chemicalCompound:chemblId	CHEMBL67507
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:206509
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:865596, activity:865597, activity:1015198, activity:1015199, activity:1015200, activity:1015201