1175631

Source:http://linkedlifedata.com/resource/chembl/compound/1175631

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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/C13H9NO4S/c1-2-11(19-5-1)12-14-18-13(17-12)8-3-4-9-10(6-8)16-7-15-9/h1-6,13H,7H2
chemicalCompound:standardIn...	VIHPYXXLEQUSDV-UHFFFAOYSA-N
chemicalCompound:canonicalS...	C1Oc2ccc(cc2O1)C3ON=C(O3)c4cccs4
chemicalCompound:molecularF...	C13H9NO4S
chemicalCompound:moleculeId	1175631
chemicalCompound:mwFreebase	275.28
chemicalCompound:alogp	3.115
chemicalCompound:hba	5
chemicalCompound:hbd	0
chemicalCompound:psa	77.52
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	3.091
chemicalCompound:acdLogD	3.091
chemicalCompound:fullMwt	275.28
chemicalCompound:chemblId	CHEMBL1828940
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1275631
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:6364317, activity:6364355, activity:6364411