1162586

Source:http://linkedlifedata.com/resource/chembl/compound/1162586

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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/C17H14N2O2S/c1-11-6-5-9-13(15(11)20)16(21)19-17-18-14(10-22-17)12-7-3-2-4-8-12/h2-10,20H,1H3,(H,18,19,21)
chemicalCompound:standardIn...	LVBHLNSWZUKKAH-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1cccc(C(=O)Nc2nc(cs2)c3ccccc3)c1O
chemicalCompound:molecularF...	C17H14N2O2S
chemicalCompound:moleculeId	1162586
chemicalCompound:mwFreebase	310.37
chemicalCompound:alogp	3.803
chemicalCompound:hba	3
chemicalCompound:hbd	2
chemicalCompound:psa	90.46
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	7.515
chemicalCompound:acdLogP	5.741
chemicalCompound:acdLogD	5.332
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	310.37
chemicalCompound:acdMostBpk...	1.716
chemicalCompound:chemblId	CHEMBL1801511
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1262586
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:6273178, activity:6273886, activity:6273911, activity:6273933, activity:6273951, activity:6273964, activity:6273972