17675

Source:http://linkedlifedata.com/resource/chembl/compound/17675

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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/C19H14N2O5S2/c22-18(12-5-2-1-3-6-12)17-14-9-8-13(11-15(14)21(24)19(17)23)20-28(25,26)16-7-4-10-27-16/h1-11,20,23-24H
chemicalCompound:standardIn...	UYVIMBKKSYDOGA-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Oc1c(C(=O)c2ccccc2)c3ccc(NS(=O)(=O)c4cccs4)cc3n1O
chemicalCompound:molecularF...	C19 H14 N2 O5 S2
chemicalCompound:moleculeId	17675
chemicalCompound:mwFreebase	414.455
chemicalCompound:alogp	1.699
chemicalCompound:hba	5
chemicalCompound:hbd	3
chemicalCompound:psa	145.25
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	8.232
chemicalCompound:acdLogP	3.512
chemicalCompound:acdLogD	3.394
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	414.455
chemicalCompound:chemblId	CHEMBL16406
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:117675
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:204115, activity:204116, activity:204117