1079559

Source:http://linkedlifedata.com/resource/chembl/compound/1079559

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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/C20H23FN2O4S/c1-27-19-9-5-4-8-18(19)22-20(24)16-14-15(10-11-17(16)21)28(25,26)23-12-6-2-3-7-13-23/h4-5,8-11,14H,2-3,6-7,12-13H2,1H3,(H,22,24)
chemicalCompound:standardIn...	SBDVDKCQHFKQNK-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COc1ccccc1NC(=O)c2cc(ccc2F)S(=O)(=O)N3CCCCCC3
chemicalCompound:molecularF...	C20H23FN2O4S
chemicalCompound:moleculeId	1079559
chemicalCompound:mwFreebase	406.471
chemicalCompound:alogp	3.294
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	84.09
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	11.8
chemicalCompound:acdLogP	3.475
chemicalCompound:acdLogD	3.475
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	406.471
chemicalCompound:chemblId	CHEMBL1698828
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1179559
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:5412908, activity:5498201, activity:5697315, activity:5865112, activity:6566951, activity:6657197, activity:7195492, activity:7348559