1275624

Source:http://linkedlifedata.com/resource/chembl/compound/1275624

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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/C13H11ClN2O3S/c1-7-4-3-5-9(11(7)19-8(2)17)12(18)16-13-15-6-10(14)20-13/h3-6H,1-2H3,(H,15,16,18)
chemicalCompound:standardIn...	KGBAMMWIEHYQGE-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(=O)Oc1c(C)cccc1C(=O)Nc2ncc(Cl)s2
chemicalCompound:molecularF...	C13H11ClN2O3S
chemicalCompound:moleculeId	1275624
chemicalCompound:mwFreebase	310.756
chemicalCompound:alogp	2.324
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	96.53
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	6.499
chemicalCompound:acdLogP	3.578
chemicalCompound:acdLogD	2.658
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	310.756
chemicalCompound:acdMostBpk...	0.643
chemicalCompound:chemblId	CHEMBL1940766
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1375624
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:8005730, activity:8005749, activity:8005763, activity:8005779, activity:8006443, activity:8006478, activity:8006512, activity:8006554