1275497

Source:http://linkedlifedata.com/resource/chembl/compound/1275497

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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/C12H9ClN2O3S/c1-7(16)18-9-5-3-2-4-8(9)11(17)15-12-14-6-10(13)19-12/h2-6H,1H3,(H,14,15,17)
chemicalCompound:standardIn...	BVLLRNZKAURPNA-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(=O)Oc1ccccc1C(=O)Nc2ncc(Cl)s2
chemicalCompound:molecularF...	C12H9ClN2O3S
chemicalCompound:moleculeId	1275497
chemicalCompound:mwFreebase	296.729
chemicalCompound:alogp	1.838
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	96.53
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	6.429
chemicalCompound:acdLogP	3.394
chemicalCompound:acdLogD	2.418
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	296.729
chemicalCompound:acdMostBpk...	0.638
chemicalCompound:chemblId	CHEMBL1940641
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1375497
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:8005738, activity:8005754, activity:8005770, activity:8006424, activity:8006451, activity:8006486, activity:8006520, activity:8006547