2046

Source:http://linkedlifedata.com/resource/chembl/compound/2046

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:2046_Aquamed_TRADE_NAME, synonym:2046_Disal_TRADE_NAME, synonym:2046_Frusemide_OTHER, synonym:2046_Frusemide_TRADE_NAME, synonym:2046_Furosemide_BAN, synonym:2046_Furosemide_FDA_ALTERNATIVE_NAME, synonym:2046_Furosemide_INN, synonym:2046_Furosemide_JAN, synonym:2046_Furosemide_TRADE_NAME, synonym:2046_Furosemide_USAN, synonym:2046_Furosemide_USP, synonym:2046_LB-502_RESEARCH_CODE, synonym:2046_Lasix_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C12H11ClN2O5S/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h1-5,15H,6H2,(H,16,17)(H2,14,18,19)
chemicalCompound:standardIn...	ZZUFCTLCJUWOSV-UHFFFAOYSA-N
chemicalCompound:canonicalS...	NS(=O)(=O)c1cc(C(=O)O)c(NCc2occc2)cc1Cl
chemicalCompound:molecularF...	C12H11ClN2O5S
chemicalCompound:moleculeId	2046
chemicalCompound:mwFreebase	330.744
chemicalCompound:alogp	1.403
chemicalCompound:hba	5
chemicalCompound:hbd	3
chemicalCompound:psa	131.01
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	3.038
chemicalCompound:acdLogP	2.304
chemicalCompound:acdLogD	-0.823
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	330.744
chemicalCompound:chemblId	CHEMBL35
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:102046
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	FUROSEMIDE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:47426
chemicalCompound:activity	activity:62336, activity:123765, activity:123766, activity:123767, activity:123768, activity:123769, activity:123770, activity:123771, activity:123772, activity:123773, activity:177334, activity:177335, activity:177336, activity:177337, activity:177338, activity:177339, activity:177340, activity:177341, activity:177342, activity:177343, activity:177344, activity:177345, activity:177346, activity:177347, activity:177348, activity:177349, activity:177350, activity:177351, activity:177352, activity:177353, activity:177354, activity:192742, activity:192743, activity:192744, activity:192745, activity:192746, activity:192747, activity:192748, activity:192749, activity:192750, activity:192751, activity:192752, activity:192753, activity:192754, activity:192755, activity:192756, activity:192757, activity:192758, activity:192759, activity:192760, activity:192761, activity:192762