1271844

Source:http://linkedlifedata.com/resource/chembl/compound/1271844

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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/C15H9N3O4S/c19-13-12(16-15(23)17-13)5-9-4-11(18-22-9)7-1-2-10-8(3-7)6-21-14(10)20/h1-5H,6H2,(H2,16,17,19,23)/b12-5+
chemicalCompound:standardIn...	HCRXOKONHSAOAP-LFYBBSHMSA-N
chemicalCompound:canonicalS...	O=C1NC(=S)N/C/1=C/c2onc(c2)c3ccc4C(=O)OCc4c3
chemicalCompound:molecularF...	C15H9N3O4S
chemicalCompound:moleculeId	1271844
chemicalCompound:mwFreebase	327.315
chemicalCompound:alogp	2.131
chemicalCompound:hba	5
chemicalCompound:hbd	2
chemicalCompound:psa	125.55
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	6.853
chemicalCompound:acdLogP	0.521
chemicalCompound:acdLogD	0
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	327.315
chemicalCompound:chemblId	CHEMBL1934376
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1371844
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:7992619, activity:7992658, activity:7992680, activity:7992702