884354

Source:http://linkedlifedata.com/resource/chembl/compound/884354

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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/C16H15ClN2O3S2/c17-12-6-5-10(9-15(12)24(18,21)22)16(20)19-13-7-8-23-14-4-2-1-3-11(13)14/h1-6,9,13H,7-8H2,(H,19,20)(H2,18,21,22)
chemicalCompound:standardIn...	LCOYYIYBAKWSIQ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	NS(=O)(=O)c1cc(ccc1Cl)C(=O)NC2CCSc3ccccc23
chemicalCompound:molecularF...	C16H15ClN2O3S2
chemicalCompound:moleculeId	884354
chemicalCompound:mwFreebase	382.885
chemicalCompound:alogp	2.442
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	122.93
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.365
chemicalCompound:acdLogP	2.703
chemicalCompound:acdLogD	2.699
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	382.885
chemicalCompound:chemblId	CHEMBL1460470
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:984354
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:3606179, activity:3780935, activity:3919506, activity:3934932, activity:4224494, activity:4278151, activity:4305815, activity:4356284, activity:4696333, activity:4889844, activity:4921748, activity:5021327, activity:5048148, activity:5344435, activity:5389462, activity:5417729, activity:5506567, activity:5506897, activity:5513525, activity:5517806, activity:5534079, activity:5567764, activity:5568287, activity:5568914, activity:5569151, activity:5572748, activity:5651182, activity:5652086, activity:5681962, activity:5760204, activity:5777177, activity:5778009, activity:5799061, activity:5847353, activity:5856768, activity:5958164, activity:5970241, activity:5973660, activity:5977057, activity:6566161, activity:6566209, activity:6584794, activity:6609836, activity:6840565, activity:6857363, activity:6883974, activity:6919667, activity:7022004, activity:7366351, activity:9546450, activity:10444501, activity:10577188, activity:10629967