73548

Source:http://linkedlifedata.com/resource/chembl/compound/73548

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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:73548_Diulo_TRADE_NAME, synonym:73548_Metolazone_BAN, synonym:73548_Metolazone_FDA_ALTERNATIVE_NAME, synonym:73548_Metolazone_INN, synonym:73548_Metolazone_JAN, synonym:73548_Metolazone_TRADE_NAME, synonym:73548_Metolazone_USAN, synonym:73548_Metolazone_USP, synonym:73548_Mykrox_TRADE_NAME, synonym:73548_SR-720-22_RESEARCH_CODE, synonym:73548_Zaroxolyn_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C16H16ClN3O3S/c1-9-5-3-4-6-14(9)20-10(2)19-13-8-12(17)15(24(18,22)23)7-11(13)16(20)21/h3-8,10,19H,1-2H3,(H2,18,22,23)
chemicalCompound:standardIn...	AQCHWTWZEMGIFD-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC1Nc2cc(Cl)c(cc2C(=O)N1c3ccccc3C)S(=O)(=O)N
chemicalCompound:molecularF...	C16H16ClN3O3S
chemicalCompound:moleculeId	73548
chemicalCompound:mwFreebase	365.835
chemicalCompound:alogp	2.463
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	100.88
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	10.001
chemicalCompound:acdLogP	3.163
chemicalCompound:acdLogD	3.162
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	365.835
chemicalCompound:chemblId	CHEMBL878
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:173548
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	METOLAZONE
chemicalCompound:activity	activity:72639, activity:72640, activity:72641, activity:72642, activity:345007, activity:781638, activity:781639, activity:781640, activity:781641, activity:1001154, activity:1406249, activity:1406250, activity:1406251, activity:1406252, activity:1406253, activity:1504558, activity:2162585, activity:2162597, activity:2162609, activity:2162621, activity:2162633, activity:2162645, activity:2162657, activity:2162669, activity:2162681, activity:2162693, activity:2162705, activity:2162717, activity:2212012, activity:2672096, activity:2672097, activity:2978309, activity:2978383, activity:2978430, activity:2990549, activity:2991877, activity:2991922, activity:2992055, activity:2993332, activity:2996339, activity:3216072, activity:3216163, activity:3217390, activity:3265063, activity:3473016, activity:3489414, activity:3672774, activity:3710735, activity:3712942, activity:3734194, activity:3741074, activity:3897394, activity:3974275, activity:4070451, activity:4177932