248706

Source:http://linkedlifedata.com/resource/chembl/compound/248706

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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/C7H10N2O3S/c1-3-4(6(10)9-13-3)2-5(8)7(11)12/h5H,2,8H2,1H3,(H,9,10)(H,11,12)
chemicalCompound:standardIn...	OPKPBXNFBGXDSB-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1snc(O)c1CC(N)C(=O)O
chemicalCompound:molecularF...	C7 H10 N2 O3 S
chemicalCompound:moleculeId	248706
chemicalCompound:mwFreebase	202.231
chemicalCompound:alogp	-2.15
chemicalCompound:hba	5
chemicalCompound:hbd	3
chemicalCompound:psa	124.68
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	2.018
chemicalCompound:acdLogP	-0.061
chemicalCompound:acdLogD	-2.634
chemicalCompound:molecularS...	molecularSpecies:ZWITTERION
chemicalCompound:fullMwt	202.231
chemicalCompound:acdMostBpk...	9.747
chemicalCompound:chemblId	CHEMBL358019
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:348706
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:70738, activity:70739, activity:70740, activity:70741, activity:70742, activity:70743