675681

Source:http://linkedlifedata.com/resource/chembl/compound/675681

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:parent	chemicalCompound:1038728
chemicalCompound:synonym	synonym:675681_Iobenguane sulfate i-123_OTHER
chemicalCompound:standardIn...	InChI=1S/C8H10IN3.H2O4S/c9-7-3-1-2-6(4-7)5-12-8(10)11;1-5(2,3)4/h1-4H,5H2,(H4,10,11,12);(H2,1,2,3,4)/i9-4;
chemicalCompound:standardIn...	NMHJRGCKGFRFAQ-JZXKKTDRSA-N
chemicalCompound:canonicalS...	NC(=N)NCc1cccc([123I])c1.OS(=O)(=O)O
chemicalCompound:molecularF...	C8H12IN3O4S
chemicalCompound:moleculeId	675681
chemicalCompound:mwFreebase	271.185
chemicalCompound:alogp	1.38
chemicalCompound:hba	1
chemicalCompound:hbd	3
chemicalCompound:psa	61.9
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	369.264
chemicalCompound:chemblId	CHEMBL1201730
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:775681
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	IOBENGUANE SULFATE I-123
chemicalCompound:firstAppro...	2008